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

Systemtic Name: 1-[(3-phenoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-phenoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-phenoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-phenoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-phenoxyphenyl)-[4-(trifluoromethyl)phenyl]methyl]pipecolinic acid Formula: C26H24F3NO3 MolecularWeight: 455.46887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC=C(C=C2)C(F)(F)F)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H24F3NO3/c27-26(28,29)20-14-12-18(13-15-20)24(30-16-5-4-11-23(30)25(31)32)19-7-6-10-22(17-19)33-21-8-2-1-3-9-21/h1-3,6-10,12-15,17,23-24H,4-5,11,16H2,(H,31,32)