[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CN2CCCCCC2=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CN2CCCCCC2=O)C

InChI

InChI=1S/C18H24N2O4/c1-13-7-8-15(10-14(13)2)19-16(21)12-24-18(23)11-20-9-5-3-4-6-17(20)22/h7-8,10H,3-6,9,11-12H2,1-2H3,(H,19,21)