(2,5-dimethylphenyl) (3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (2,5-dimethylphenyl) (3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (2,5-dimethylphenyl) (3S)-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid (2,5-dimethylphenyl) ester IUPAC Name: (2,5-dimethylphenyl) (3S)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(p-tolyl)pyrrolidine-3-carboxylic acid (2,5-dimethylphenyl) ester Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H21NO3/c1-13-5-8-17(9-6-13)21-12-16(11-19(21)22)20(23)24-18-10-14(2)4-7-15(18)3/h4-10,16H,11-12H2,1-3H3/t16-/m0/s1