1-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)piperidine-4-carboxylic acid Openeye Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)piperidine-4-carboxylic acid CAS Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)piperidine-4-carboxylic acid Traditional Name: 1-(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)isonipecotic acid Formula: C21H19ClN2O3 MolecularWeight: 382.84016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C21H19ClN2O3/c22-15-6-7-17-16(12-15)18(13-4-2-1-3-5-13)19(20(25)23-17)24-10-8-14(9-11-24)21(26)27/h1-7,12,14H,8-11H2,(H,23,25)(H,26,27)