[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC(=O)CCC(=O)C2=CC=CS2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC(=O)CCC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C18H19NO6S/c1-23-14-7-5-12(10-15(14)24-2)19-17(21)11-25-18(22)8-6-13(20)16-4-3-9-26-16/h3-5,7,9-10H,6,8,11H2,1-2H3,(H,19,21)