quinolin-8-yl (3S)-1-(3,5-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: quinolin-8-yl (3S)-1-(3,5-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: 8-quinolyl (3S)-1-(3,5-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(3,5-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl (3S)-1-(3,5-dimethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(3,5-dimethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid 8-quinolyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O3/c1-14-9-15(2)11-18(10-14)24-13-17(12-20(24)25)22(26)27-19-7-3-5-16-6-4-8-23-21(16)19/h3-11,17H,12-13H2,1-2H3/t17-/m0/s1