[2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate Openeye Name: [2-(4-methoxycarbonylanilino)-2-oxo-ethyl] (3S)-5-oxo-1-phenyl-pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-phenyl-3-pyrrolidinecarboxylic acid [2-(4-methoxycarbonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxycarbonylanilino)-2-oxoethyl] (3S)-5-oxo-1-phenylpyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-phenyl-pyrrolidine-3-carboxylic acid [2-(4-carbomethoxyanilino)-2-keto-ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6/c1-28-20(26)14-7-9-16(10-8-14)22-18(24)13-29-21(27)15-11-19(25)23(12-15)17-5-3-2-4-6-17/h2-10,15H,11-13H2,1H3,(H,22,24)/t15-/m0/s1