1-[2-pyridin-2-yl-1-[2-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-pyridin-2-yl-1-[2-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(2-pyridyl)-1-[2-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(2-pyridinyl)-1-[2-(trifluoromethyl)phenyl]ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-pyridin-2-yl-1-[2-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(2-pyridyl)-1-[2-(trifluoromethyl)phenyl]ethyl]nipecotic acid Formula: C20H21F3N2O2 MolecularWeight: 378.38815

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(CC2=CC=CC=N2)C3=CC=CC=C3C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(CC2=CC=CC=N2)C3=CC=CC=C3C(F)(F)F)C(=O)O

InChI

InChI=1S/C20H21F3N2O2/c21-20(22,23)17-9-2-1-8-16(17)18(12-15-7-3-4-10-24-15)25-11-5-6-14(13-25)19(26)27/h1-4,7-10,14,18H,5-6,11-13H2,(H,26,27)