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

Systemtic Name: 4-phenyl-1-[3-[4-(trifluoromethyl)phenyl]propanoyl]piperidine-4-carboxylic acid Openeye Name: 4-phenyl-1-[3-[4-(trifluoromethyl)phenyl]propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-3-[4-(trifluoromethyl)phenyl]propyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 4-phenyl-1-[3-[4-(trifluoromethyl)phenyl]propanoyl]piperidine-4-carboxylic acid Traditional Name: 4-phenyl-1-[3-[4-(trifluoromethyl)phenyl]propanoyl]isonipecotic acid Formula: C22H22F3NO3 MolecularWeight: 405.41019

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)C(=O)CCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)C(=O)CCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H22F3NO3/c23-22(24,25)18-9-6-16(7-10-18)8-11-19(27)26-14-12-21(13-15-26,20(28)29)17-4-2-1-3-5-17/h1-7,9-10H,8,11-15H2,(H,28,29)