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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CC=CC=C2C(F)(F)F)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CC=CC=C2C(F)(F)F)N3CCCCC3C(=O)O

InChI

InChI=1S/C20H21F3N2O2/c1-13-7-6-11-24-17(13)18(25-12-5-4-10-16(25)19(26)27)14-8-2-3-9-15(14)20(21,22)23/h2-3,6-9,11,16,18H,4-5,10,12H2,1H3,(H,26,27)