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

Systemtic Name: 1-[(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(4-phenylphenyl)-[2-(trifluoromethyl)phenyl]methyl]nipecotic acid Formula: C26H24F3NO2 MolecularWeight: 439.46947

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4C(F)(F)F)C(=O)O

InChI

InChI=1S/C26H24F3NO2/c27-26(28,29)23-11-5-4-10-22(23)24(30-16-6-9-21(17-30)25(31)32)20-14-12-19(13-15-20)18-7-2-1-3-8-18/h1-5,7-8,10-15,21,24H,6,9,16-17H2,(H,31,32)