1-[quinolin-4-yl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[quinolin-4-yl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid Openeye Name: 1-[4-quinolyl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid CAS Name: 1-[4-quinolinyl-[3-(trifluoromethyl)phenyl]methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[quinolin-4-yl-[3-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid Traditional Name: 1-[4-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=CC=NC4=CC=CC=C34

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=CC=C2)C(F)(F)F)C3=CC=NC4=CC=CC=C34

InChI

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