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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3

InChI

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