[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 4-(5-methyl-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-methyl-2-thiophenyl)-4-oxobutanoic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 4-(5-methylthiophen-2-yl)-4-oxobutanoate Traditional Name: 4-keto-4-(5-methyl-2-thienyl)butyric acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)C)C

InChI

InChI=1S/C19H21NO4S/c1-12-5-4-6-15(14(12)3)20-18(22)11-24-19(23)10-8-16(21)17-9-7-13(2)25-17/h4-7,9H,8,10-11H2,1-3H3,(H,20,22)