[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(3-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl] (3S)-1-(3-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3-acetylanilino)-2-oxo-ethyl] (3S)-1-(m-tolyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(3-acetylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-acetylanilino)-2-oxoethyl] (3S)-1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(m-tolyl)pyrrolidine-3-carboxylic acid [2-(3-acetylanilino)-2-keto-ethyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C[C@H](CC2=O)C(=O)OCC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H22N2O5/c1-14-5-3-8-19(9-14)24-12-17(11-21(24)27)22(28)29-13-20(26)23-18-7-4-6-16(10-18)15(2)25/h3-10,17H,11-13H2,1-2H3,(H,23,26)/t17-/m0/s1