[4-(2-methylbutan-2-yl)phenyl] (3S)-1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [4-(2-methylbutan-2-yl)phenyl] (3S)-1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [4-(1,1-dimethylpropyl)phenyl] (3S)-1-(o-tolyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [4-(2-methylbutan-2-yl)phenyl] ester IUPAC Name: [4-(2-methylbutan-2-yl)phenyl] (3S)-1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(o-tolyl)pyrrolidine-3-carboxylic acid (4-tert-amylphenyl) ester Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2CC(=O)N(C2)C3=CC=CC=C3C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3C

InChI

InChI=1S/C23H27NO3/c1-5-23(3,4)18-10-12-19(13-11-18)27-22(26)17-14-21(25)24(15-17)20-9-7-6-8-16(20)2/h6-13,17H,5,14-15H2,1-4H3/t17-/m0/s1