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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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