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

Systemtic Name: 1-[pyridin-3-yl-[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-pyridyl-[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[3-pyridinyl-[4-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[pyridin-3-yl-[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-pyridyl-[4-(trifluoromethyl)phenyl]methyl]nipecotic acid Formula: C19H19F3N2O2 MolecularWeight: 364.36157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C19H19F3N2O2/c20-19(21,22)16-7-5-13(6-8-16)17(14-3-1-9-23-11-14)24-10-2-4-15(12-24)18(25)26/h1,3,5-9,11,15,17H,2,4,10,12H2,(H,25,26)