quinolin-8-yl (3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: quinolin-8-yl (3S)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: 8-quinolyl (3S)-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxylate CAS Name: (3S)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (3S)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-(p-tolyl)pyrrolidine-3-carboxylic acid 8-quinolyl ester Formula: C21H18N2O3 MolecularWeight: 346.37922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)OC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H18N2O3/c1-14-7-9-17(10-8-14)23-13-16(12-19(23)24)21(25)26-18-6-2-4-15-5-3-11-22-20(15)18/h2-11,16H,12-13H2,1H3/t16-/m0/s1