id
int64 0
300k
| molecules
dict | ground_truth
stringlengths 2
33
| messages
listlengths 3
3
|
|---|---|---|---|
0 | {
"selfies": [],
"smiles": []
} | C23H30ClN3O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named 4-N-(6-chloro-2-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C23H30ClN3O",
"role": "assistant"
}
] |
1 | {
"selfies": [],
"smiles": []
} | C2H5NO3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the chemical IUPAC name 2-aminooxyacetic acid into its molecular formula.",
"role": "user"
},
{
"content": "C2H5NO3",
"role": "assistant"
}
] |
2 | {
"selfies": [],
"smiles": []
} | C11H17N2+ | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 1-methyl-3-(1-methylpyrrolidin-2-yl)pyridin-1-ium by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C11H17N2+",
"role": "assistant"
}
] |
3 | {
"selfies": [],
"smiles": []
} | C40H66O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the IUPAC name of a molecule 3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-ol into molecular formula.",
"role": "user"
},
{
"content": "C40H66O",
"role": "assistant"
}
] |
4 | {
"selfies": [],
"smiles": []
} | C29H51N3O18P2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name [3-amino-2-[[[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl] 3-hydroxytetradecanoate ?",
"role": "user"
},
{
"content": "C29H51N3O18P2",
"role": "assistant"
}
] |
5 | {
"selfies": [],
"smiles": []
} | C28H41N7O3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the chemical IUPAC name 1-tert-butyl-3-[2-[4-(diethylamino)butylamino]-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]urea into its molecular formula.",
"role": "user"
},
{
"content": "C28H41N7O3",
"role": "assistant"
}
] |
6 | {
"selfies": [],
"smiles": []
} | C16H14FN3O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 6-amino-2-(fluoromethyl)-3-(2-methylphenyl)quinazolin-4-one ?",
"role": "user"
},
{
"content": "C16H14FN3O",
"role": "assistant"
}
] |
7 | {
"selfies": [],
"smiles": []
} | C20H30 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "2-(3,7-dimethylnona-1,3,5,7-tetraenyl)-1,3,3-trimethylcyclohexene The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C20H30",
"role": "assistant"
}
] |
8 | {
"selfies": [],
"smiles": []
} | C18H15NO3S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named methyl 5-oxo-9b-phenyl-2,3-dihydro-[1,3]thiazolo[2,3-a]isoindole-3-carboxylate is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C18H15NO3S",
"role": "assistant"
}
] |
9 | {
"selfies": [],
"smiles": []
} | C32H45N5O7 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule methyl 6-[3-butan-2-yl-6-(1-methoxyindol-3-yl)-2,5,8,11-tetraoxo-1,4,7,10-tetrazabicyclo[10.4.0]hexadecan-9-yl]hexanoate ?",
"role": "user"
},
{
"content": "C32H45N5O7",
"role": "assistant"
}
] |
10 | {
"selfies": [],
"smiles": []
} | C7H9N3O4S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by [2-(pyridine-4-carbonyl)hydrazinyl]methanesulfonic acid ?",
"role": "user"
},
{
"content": "C7H9N3O4S",
"role": "assistant"
}
] |
11 | {
"selfies": [],
"smiles": []
} | C19H26O4S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "[2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite is the IUPAC name of a molecule. Please give its molecular formula.",
"role": "user"
},
{
"content": "C19H26O4S",
"role": "assistant"
}
] |
12 | {
"selfies": [],
"smiles": []
} | C51H79NO13 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 1,18-dihydroxy-12-[1-(4-hydroxy-3-methoxycyclohexyl)propan-2-yl]-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C51H79NO13",
"role": "assistant"
}
] |
13 | {
"selfies": [],
"smiles": []
} | C16H23ClN4O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by N'-[(4-methoxyphenyl)methyl]-N,N-dimethyl-N'-pyrimidin-2-ylethane-1,2-diamine;hydrochloride ?",
"role": "user"
},
{
"content": "C16H23ClN4O",
"role": "assistant"
}
] |
14 | {
"selfies": [],
"smiles": []
} | C12H9ClO2S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 1-(benzenesulfonyl)-4-chlorobenzene ?",
"role": "user"
},
{
"content": "C12H9ClO2S",
"role": "assistant"
}
] |
15 | {
"selfies": [],
"smiles": []
} | C15H11NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by 2,5-diphenyl-1,3-oxazole ?",
"role": "user"
},
{
"content": "C15H11NO",
"role": "assistant"
}
] |
16 | {
"selfies": [],
"smiles": []
} | C8H7NS | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "2-methyl-1,3-benzothiazole The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C8H7NS",
"role": "assistant"
}
] |
17 | {
"selfies": [],
"smiles": []
} | C18H32CaN2O10 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Please write the molecular formula of the molecule calcium;3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate .",
"role": "user"
},
{
"content": "C18H32CaN2O10",
"role": "assistant"
}
] |
18 | {
"selfies": [],
"smiles": []
} | C3H9O3PS | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "trimethoxy(sulfanylidene)-lambda5-phosphane The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C3H9O3PS",
"role": "assistant"
}
] |
19 | {
"selfies": [],
"smiles": []
} | C11H14ClN5 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 1-(4-chlorophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C11H14ClN5",
"role": "assistant"
}
] |
20 | {
"selfies": [],
"smiles": []
} | C5H2F7NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named 1,1,1,2,2,3,3-heptafluoro-4-isocyanatobutane is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C5H2F7NO",
"role": "assistant"
}
] |
21 | {
"selfies": [],
"smiles": []
} | C3H6HgN4 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named (N'-cyanocarbamimidoyl)azanide;methylmercury(1+) is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C3H6HgN4",
"role": "assistant"
}
] |
22 | {
"selfies": [],
"smiles": []
} | C4H10S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "2-methylpropane-1-thiol is the IUPAC name of a molecule. Please give its molecular formula.",
"role": "user"
},
{
"content": "C4H10S",
"role": "assistant"
}
] |
23 | {
"selfies": [],
"smiles": []
} | C32H66 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance dotriacontane .",
"role": "user"
},
{
"content": "C32H66",
"role": "assistant"
}
] |
24 | {
"selfies": [],
"smiles": []
} | C14H12 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the IUPAC name of a molecule 9,10-dihydroanthracene into molecular formula.",
"role": "user"
},
{
"content": "C14H12",
"role": "assistant"
}
] |
25 | {
"selfies": [],
"smiles": []
} | C5H10N2O3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the chemical IUPAC name ethyl N-ethyl-N-nitrosocarbamate into its molecular formula.",
"role": "user"
},
{
"content": "C5H10N2O3",
"role": "assistant"
}
] |
26 | {
"selfies": [],
"smiles": []
} | C6H4Br2O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 2,4-dibromophenol by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C6H4Br2O",
"role": "assistant"
}
] |
27 | {
"selfies": [],
"smiles": []
} | C5H5NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 1H-pyridin-4-one by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C5H5NO",
"role": "assistant"
}
] |
28 | {
"selfies": [],
"smiles": []
} | C16H16I2O3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name 4-[4-(2-hydroxyethyl)-2,6-diiodophenoxy]-2,6-dimethylphenol ?",
"role": "user"
},
{
"content": "C16H16I2O3",
"role": "assistant"
}
] |
29 | {
"selfies": [],
"smiles": []
} | C6H11O3P | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 4-ethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane ?",
"role": "user"
},
{
"content": "C6H11O3P",
"role": "assistant"
}
] |
30 | {
"selfies": [],
"smiles": []
} | C10H21Cl | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as 3-chlorodecane using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "C10H21Cl",
"role": "assistant"
}
] |
31 | {
"selfies": [],
"smiles": []
} | C22H17NOS | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "O-naphthalen-2-yl N-methyl-N-naphthalen-1-ylcarbamothioate The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C22H17NOS",
"role": "assistant"
}
] |
32 | {
"selfies": [],
"smiles": []
} | C12H13N3O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule N'-benzyl-3-methyl-1,2-oxazole-5-carbohydrazide ?",
"role": "user"
},
{
"content": "C12H13N3O2",
"role": "assistant"
}
] |
33 | {
"selfies": [],
"smiles": []
} | C5H9Cl2NSi | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 4-[dichloro(methyl)silyl]butanenitrile ?",
"role": "user"
},
{
"content": "C5H9Cl2NSi",
"role": "assistant"
}
] |
34 | {
"selfies": [],
"smiles": []
} | C23H23NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "4-tritylmorpholine is the IUPAC name of a molecule. Please give its molecular formula.",
"role": "user"
},
{
"content": "C23H23NO",
"role": "assistant"
}
] |
35 | {
"selfies": [],
"smiles": []
} | C8H16 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named 3-methylideneheptane is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C8H16",
"role": "assistant"
}
] |
36 | {
"selfies": [],
"smiles": []
} | C7H12O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the chemical IUPAC name tert-butyl prop-2-enoate into its molecular formula.",
"role": "user"
},
{
"content": "C7H12O2",
"role": "assistant"
}
] |
37 | {
"selfies": [],
"smiles": []
} | C9H12N6O6 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by 2-[3,5-bis(2-amino-2-oxoethyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]acetamide ?",
"role": "user"
},
{
"content": "C9H12N6O6",
"role": "assistant"
}
] |
38 | {
"selfies": [],
"smiles": []
} | C8Cl4N2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile ?",
"role": "user"
},
{
"content": "C8Cl4N2",
"role": "assistant"
}
] |
39 | {
"selfies": [],
"smiles": []
} | C10H11Cl2NO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as 1-chloropropan-2-yl N-(3-chlorophenyl)carbamate using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "C10H11Cl2NO2",
"role": "assistant"
}
] |
40 | {
"selfies": [],
"smiles": []
} | C7H8HgN2O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule (carbamoylamino)-phenylmercury ?",
"role": "user"
},
{
"content": "C7H8HgN2O",
"role": "assistant"
}
] |
41 | {
"selfies": [],
"smiles": []
} | C9H20INO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name 2-butanoyloxyethyl(trimethyl)azanium;iodide ?",
"role": "user"
},
{
"content": "C9H20INO2",
"role": "assistant"
}
] |
42 | {
"selfies": [],
"smiles": []
} | C8H12IN | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule 1,2,6-trimethylpyridin-1-ium;iodide ?",
"role": "user"
},
{
"content": "C8H12IN",
"role": "assistant"
}
] |
43 | {
"selfies": [],
"smiles": []
} | C14H20ClFN2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance N,N-diethyl-2-(6-fluoro-1H-indol-3-yl)ethanamine;hydrochloride .",
"role": "user"
},
{
"content": "C14H20ClFN2",
"role": "assistant"
}
] |
44 | {
"selfies": [],
"smiles": []
} | C22H28ClNO3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "(1-ethylpyrrolidin-1-ium-3-yl) 2-ethoxy-2,2-diphenylacetate;chloride The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C22H28ClNO3",
"role": "assistant"
}
] |
45 | {
"selfies": [],
"smiles": []
} | C21H14ClN3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "2-(4-chlorophenyl)-4,6-diphenyl-1,3,5-triazine The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C21H14ClN3",
"role": "assistant"
}
] |
46 | {
"selfies": [],
"smiles": []
} | C9H19N3O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name 3-(azepan-1-yl)-N'-hydroxypropanimidamide ?",
"role": "user"
},
{
"content": "C9H19N3O",
"role": "assistant"
}
] |
47 | {
"selfies": [],
"smiles": []
} | C21H27N3O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule 2-[2-(4-ethoxyphenoxy)benzimidazol-1-yl]-N,N-diethylethanamine ?",
"role": "user"
},
{
"content": "C21H27N3O2",
"role": "assistant"
}
] |
48 | {
"selfies": [],
"smiles": []
} | C9H11N2Na2O9P | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by disodium;[(2R,3S,4S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate ?",
"role": "user"
},
{
"content": "C9H11N2Na2O9P",
"role": "assistant"
}
] |
49 | {
"selfies": [],
"smiles": []
} | C8H7ClO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule (2-chlorophenyl) acetate ?",
"role": "user"
},
{
"content": "C8H7ClO2",
"role": "assistant"
}
] |
50 | {
"selfies": [],
"smiles": []
} | C20H24N2S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named 1-(5-benzylsulfanyl-1H-indol-3-yl)-N,N-dimethylpropan-2-amine is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C20H24N2S",
"role": "assistant"
}
] |
51 | {
"selfies": [],
"smiles": []
} | C15H26N2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the chemical IUPAC name N,N-diethyl-N'-phenyl-N'-propan-2-ylethane-1,2-diamine into its molecular formula.",
"role": "user"
},
{
"content": "C15H26N2",
"role": "assistant"
}
] |
52 | {
"selfies": [],
"smiles": []
} | C5H9ClN2O3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as ethyl N-(2-chloroethyl)-N-nitrosocarbamate using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "C5H9ClN2O3",
"role": "assistant"
}
] |
53 | {
"selfies": [],
"smiles": []
} | Cl2Fe | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as dichloroiron using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "Cl2Fe",
"role": "assistant"
}
] |
54 | {
"selfies": [],
"smiles": []
} | C16H16N2O4 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by [3-(methoxycarbonylamino)phenyl] N-(3-methylphenyl)carbamate ?",
"role": "user"
},
{
"content": "C16H16N2O4",
"role": "assistant"
}
] |
55 | {
"selfies": [],
"smiles": []
} | C23H32I2N2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named dimethyl-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)-[2-(trimethylazaniumyl)ethyl]azanium;diiodide by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C23H32I2N2",
"role": "assistant"
}
] |
56 | {
"selfies": [],
"smiles": []
} | C29H31NO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance 6-phenyl-5-[4-(2-piperidin-1-ylethoxy)phenyl]-7,8-dihydronaphthalen-2-ol .",
"role": "user"
},
{
"content": "C29H31NO2",
"role": "assistant"
}
] |
57 | {
"selfies": [],
"smiles": []
} | C14H19NO6 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule 1-[4-[[(2R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]ethanone ?",
"role": "user"
},
{
"content": "C14H19NO6",
"role": "assistant"
}
] |
58 | {
"selfies": [],
"smiles": []
} | C12H6N2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule 2-(3-phenylprop-2-ynylidene)propanedinitrile ?",
"role": "user"
},
{
"content": "C12H6N2",
"role": "assistant"
}
] |
59 | {
"selfies": [],
"smiles": []
} | C17H22ClNO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "benzyl-dimethyl-(2-phenoxyethyl)azanium;chloride is the IUPAC name of a molecule. Please give its molecular formula.",
"role": "user"
},
{
"content": "C17H22ClNO",
"role": "assistant"
}
] |
60 | {
"selfies": [],
"smiles": []
} | C12H15NO3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named (2-methoxy-4-prop-2-enylphenyl) N-methylcarbamate is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C12H15NO3",
"role": "assistant"
}
] |
61 | {
"selfies": [],
"smiles": []
} | C18H23NO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule 3-methoxy-4-(5-phenylpentoxy)aniline ?",
"role": "user"
},
{
"content": "C18H23NO2",
"role": "assistant"
}
] |
62 | {
"selfies": [],
"smiles": []
} | C27H34O6 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance 1-O-benzyl 2-O-[2,2,4-trimethyl-1-(2-methylpropanoyloxy)pentan-3-yl] benzene-1,2-dicarboxylate .",
"role": "user"
},
{
"content": "C27H34O6",
"role": "assistant"
}
] |
63 | {
"selfies": [],
"smiles": []
} | C24H30ClN3O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Please write the molecular formula of the molecule 2-[4-[(2,6-dimethylphenyl)carbamoyl]quinolin-2-yl]oxyethyl-diethylazanium;chloride .",
"role": "user"
},
{
"content": "C24H30ClN3O2",
"role": "assistant"
}
] |
64 | {
"selfies": [],
"smiles": []
} | C17H14O5 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance 2-(ethoxymethyl)-1,3-dihydroxyanthracene-9,10-dione .",
"role": "user"
},
{
"content": "C17H14O5",
"role": "assistant"
}
] |
65 | {
"selfies": [],
"smiles": []
} | C12H14O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name 7-methoxy-2,2-dimethylchromene ?",
"role": "user"
},
{
"content": "C12H14O2",
"role": "assistant"
}
] |
66 | {
"selfies": [],
"smiles": []
} | C22H44O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule ethyl icosanoate ?",
"role": "user"
},
{
"content": "C22H44O2",
"role": "assistant"
}
] |
67 | {
"selfies": [],
"smiles": []
} | C19H26ClNO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as 2-[bis(4-methylphenyl)methoxy]ethyl-dimethylazanium;chloride using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "C19H26ClNO",
"role": "assistant"
}
] |
68 | {
"selfies": [],
"smiles": []
} | C10H20O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Translate the chemical IUPAC name 2-propan-2-yl-5-propyl-1,3-dioxane into its molecular formula.",
"role": "user"
},
{
"content": "C10H20O2",
"role": "assistant"
}
] |
69 | {
"selfies": [],
"smiles": []
} | C3H8O4S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "2-hydroxyethyl methanesulfonate The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C3H8O4S",
"role": "assistant"
}
] |
70 | {
"selfies": [],
"smiles": []
} | C11H20O5 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "diethyl 2-(2-methoxyethyl)-2-methylpropanedioate The above is the IUPAC name of a molecule. Write its molecular formula.",
"role": "user"
},
{
"content": "C11H20O5",
"role": "assistant"
}
] |
71 | {
"selfies": [],
"smiles": []
} | C8H19BrN2O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the IUPAC name of a molecule (5-amino-5-oxopentyl)-trimethylazanium;bromide into molecular formula.",
"role": "user"
},
{
"content": "C8H19BrN2O",
"role": "assistant"
}
] |
72 | {
"selfies": [],
"smiles": []
} | C5H11NO2S | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by 2-amino-3-ethylsulfanylpropanoic acid ?",
"role": "user"
},
{
"content": "C5H11NO2S",
"role": "assistant"
}
] |
73 | {
"selfies": [],
"smiles": []
} | C9H18O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Please write the molecular formula of the molecule nonanal .",
"role": "user"
},
{
"content": "C9H18O",
"role": "assistant"
}
] |
74 | {
"selfies": [],
"smiles": []
} | C3H10HgO5Si | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name 2-methoxyethylmercury(1+);trihydroxy(oxido)silane ?",
"role": "user"
},
{
"content": "C3H10HgO5Si",
"role": "assistant"
}
] |
75 | {
"selfies": [],
"smiles": []
} | C21H30ClNO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance (5-hydroxy-4,4-diphenylheptan-2-yl)-dimethylazanium;chloride .",
"role": "user"
},
{
"content": "C21H30ClNO",
"role": "assistant"
}
] |
76 | {
"selfies": [],
"smiles": []
} | C19H22ClN | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 3-benzhydrylidene-1-ethylpyrrolidine;hydrochloride ?",
"role": "user"
},
{
"content": "C19H22ClN",
"role": "assistant"
}
] |
77 | {
"selfies": [],
"smiles": []
} | Mn2O8Zn | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule zinc;dipermanganate ?",
"role": "user"
},
{
"content": "Mn2O8Zn",
"role": "assistant"
}
] |
78 | {
"selfies": [],
"smiles": []
} | C26H27ClN2O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named 3-(4-chlorophenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-phenylpropan-1-one is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C26H27ClN2O2",
"role": "assistant"
}
] |
79 | {
"selfies": [],
"smiles": []
} | C13H15NO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as 5,6-dimethoxy-N-methylnaphthalen-1-amine using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "C13H15NO2",
"role": "assistant"
}
] |
80 | {
"selfies": [],
"smiles": []
} | C16H19AsS | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the IUPAC name of a molecule butyl-phenyl-phenylsulfanylarsane into molecular formula.",
"role": "user"
},
{
"content": "C16H19AsS",
"role": "assistant"
}
] |
81 | {
"selfies": [],
"smiles": []
} | C11H14Cl6N4 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Name the molecular formula for the molecule established as N,N-dipropyl-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine using the IUPAC nomenclature.",
"role": "user"
},
{
"content": "C11H14Cl6N4",
"role": "assistant"
}
] |
82 | {
"selfies": [],
"smiles": []
} | C9H16O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Under IUPAC nomenclature, a molecule named 2-methoxyoct-2-en-4-one is given. What is its corresponding molecular formula?",
"role": "user"
},
{
"content": "C9H16O2",
"role": "assistant"
}
] |
83 | {
"selfies": [],
"smiles": []
} | C8H14Cl3NO2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "4,4,4-trichloro-N,N-diethyl-3-hydroxybutanamide is the IUPAC name of a molecule. Please give its molecular formula.",
"role": "user"
},
{
"content": "C8H14Cl3NO2",
"role": "assistant"
}
] |
84 | {
"selfies": [],
"smiles": []
} | C12H17Cl2NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance [(1S)-8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-methylazanium;chloride .",
"role": "user"
},
{
"content": "C12H17Cl2NO",
"role": "assistant"
}
] |
85 | {
"selfies": [],
"smiles": []
} | C4H5N7 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Please write the molecular formula of the molecule 6-(diazomethyl)-1,3,5-triazine-2,4-diamine .",
"role": "user"
},
{
"content": "C4H5N7",
"role": "assistant"
}
] |
86 | {
"selfies": [],
"smiles": []
} | C8H11Cl2N3S2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the IUPAC name of a molecule 2-[bis(methylsulfanyl)methyl]-4-(dichloromethyl)-6-methyl-1,3,5-triazine into molecular formula.",
"role": "user"
},
{
"content": "C8H11Cl2N3S2",
"role": "assistant"
}
] |
87 | {
"selfies": [],
"smiles": []
} | C11H12ClNO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule N-(2-chloroethyl)-3-phenylprop-2-enamide ?",
"role": "user"
},
{
"content": "C11H12ClNO",
"role": "assistant"
}
] |
88 | {
"selfies": [],
"smiles": []
} | C9H12Cl3N3O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Provide the molecular formula for the IUPAC named substance 2-butoxy-4-methyl-6-(trichloromethyl)-1,3,5-triazine .",
"role": "user"
},
{
"content": "C9H12Cl3N3O",
"role": "assistant"
}
] |
89 | {
"selfies": [],
"smiles": []
} | C15H22ClNO5 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 2-morpholin-4-ium-2-ylethyl 2-(2-methoxyphenoxy)acetate;chloride by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C15H22ClNO5",
"role": "assistant"
}
] |
90 | {
"selfies": [],
"smiles": []
} | C10H13Cl2NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the molecule identified by (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)azanium;chloride ?",
"role": "user"
},
{
"content": "C10H13Cl2NO",
"role": "assistant"
}
] |
91 | {
"selfies": [],
"smiles": []
} | C17H24N2O | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Convert the IUPAC name of a molecule N-[2-(5-methoxy-2,4-dimethyl-1H-indol-3-yl)ethyl]-2-methylprop-2-en-1-amine into molecular formula.",
"role": "user"
},
{
"content": "C17H24N2O",
"role": "assistant"
}
] |
92 | {
"selfies": [],
"smiles": []
} | C24H39ClN2O3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name [(1S,2S)-2-piperidin-1-ium-1-ylcyclohexyl] N-(4-hexoxyphenyl)carbamate;chloride ?",
"role": "user"
},
{
"content": "C24H39ClN2O3",
"role": "assistant"
}
] |
93 | {
"selfies": [],
"smiles": []
} | C15H19NO5 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 1-(1,2-oxazolidin-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one ?",
"role": "user"
},
{
"content": "C15H19NO5",
"role": "assistant"
}
] |
94 | {
"selfies": [],
"smiles": []
} | C13H16N6 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name 9-N,9-N,5,7-tetramethyl-3,5,11,13-tetrazatricyclo[8.3.0.02,6]trideca-1(13),2(6),3,7,9,11-hexaene-4,9-diamine ?",
"role": "user"
},
{
"content": "C13H16N6",
"role": "assistant"
}
] |
95 | {
"selfies": [],
"smiles": []
} | C25H31NO9 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named 2-hydroxy-2-oxoacetate;2-[[5-(1-hydroxy-3-phenylpropyl)-4,7-dimethoxy-1-benzofuran-6-yl]oxy]ethyl-dimethylazanium by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C25H31NO9",
"role": "assistant"
}
] |
96 | {
"selfies": [],
"smiles": []
} | C12H16N2O3 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "What is the molecular formula of the compound with this IUPAC name N-hydroxy-N-(morpholin-4-ylmethyl)benzamide ?",
"role": "user"
},
{
"content": "C12H16N2O3",
"role": "assistant"
}
] |
97 | {
"selfies": [],
"smiles": []
} | C18H19NO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Please write the molecular formula of the molecule (3S,4R)-2,3,8-trimethyl-4-phenyl-3,4-dihydroisoquinolin-1-one .",
"role": "user"
},
{
"content": "C18H19NO",
"role": "assistant"
}
] |
98 | {
"selfies": [],
"smiles": []
} | C7H12O2 | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "Can you give the molecular formula of the molecule 4-ethyl-4-methyloxolan-2-one ?",
"role": "user"
},
{
"content": "C7H12O2",
"role": "assistant"
}
] |
99 | {
"selfies": [],
"smiles": []
} | C18H28INO | [
{
"content": "You are a chemist. Please follow the instructions to convert the structure to the corresponding name.",
"role": "system"
},
{
"content": "For the molecule named triethyl-(6-hydroxy-6-phenylhex-4-ynyl)azanium;iodide by IUPAC nomenclature, provide its molecular formula.",
"role": "user"
},
{
"content": "C18H28INO",
"role": "assistant"
}
] |