1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-isonipecotic acid Formula: C25H27FN2O2 MolecularWeight: 406.492483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2CCC(CC2)(C3=CC=CC=C3)C(=O)O)(C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CCC1N2CCC(CC2)(C3=CC=CC=C3)C(=O)O)(C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN2O2/c26-21-8-6-19(7-9-21)24(18-27)12-10-22(11-13-24)28-16-14-25(15-17-28,23(29)30)20-4-2-1-3-5-20/h1-9,22H,10-17H2,(H,29,30)