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

Systemtic Name: 1-[(4-phenylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-phenylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-phenylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-phenylphenyl)-[3-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(4-phenylphenyl)-[3-(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=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

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

InChI

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