[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (3R)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] (3R)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-ethyl] (3R)-5-oxo-1-phenyl-pyrrolidine-3-carboxylate CAS Name: (3R)-5-oxo-1-phenyl-3-pyrrolidinecarboxylic acid [2-(2,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylanilino)-2-oxoethyl] (3R)-5-oxo-1-phenylpyrrolidine-3-carboxylate Traditional Name: (3R)-5-keto-1-phenyl-pyrrolidine-3-carboxylic acid [2-(2,5-dimethylanilino)-2-keto-ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)COC(=O)[C@@H]2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-14-8-9-15(2)18(10-14)22-19(24)13-27-21(26)16-11-20(25)23(12-16)17-6-4-3-5-7-17/h3-10,16H,11-13H2,1-2H3,(H,22,24)/t16-/m1/s1