1-[quinolin-3-yl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[quinolin-3-yl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid Openeye Name: 1-[3-quinolyl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid CAS Name: 1-[3-quinolinyl-[3-(trifluoromethyl)phenyl]methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[quinolin-3-yl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid Traditional Name: 1-[3-quinolyl-[3-(trifluoromethyl)phenyl]methyl]pipecolinic acid Formula: C23H21F3N2O2 MolecularWeight: 414.42025

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)C(F)(F)F)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)C(F)(F)F)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C23H21F3N2O2/c24-23(25,26)18-8-5-7-16(13-18)21(28-11-4-3-10-20(28)22(29)30)17-12-15-6-1-2-9-19(15)27-14-17/h1-2,5-9,12-14,20-21H,3-4,10-11H2,(H,29,30)