[4-(2-phenylpropan-2-yl)phenyl] (3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] (3S)-1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] (3S)-1-(3,4-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] (3S)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3,4-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid (4-cumylphenyl) ester Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4)C

InChI

InChI=1S/C28H29NO3/c1-19-10-13-24(16-20(19)2)29-18-21(17-26(29)30)27(31)32-25-14-11-23(12-15-25)28(3,4)22-8-6-5-7-9-22/h5-16,21H,17-18H2,1-4H3/t21-/m0/s1