1-(3-cyano-3-phenyl-3-pyridin-3-yl-propyl)-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-(3-cyano-3-phenyl-3-pyridin-3-yl-propyl)-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[3-cyano-3-phenyl-3-(3-pyridyl)propyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[3-cyano-3-phenyl-3-(3-pyridinyl)propyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-(3-cyano-3-phenyl-3-pyridin-3-ylpropyl)-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[3-cyano-3-phenyl-3-(3-pyridyl)propyl]-4-phenyl-isonipecotic acid Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC(C#N)(C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C(=O)O)CCC(C#N)(C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C27H27N3O2/c28-21-27(23-10-5-2-6-11-23,24-12-7-16-29-20-24)15-19-30-17-13-26(14-18-30,25(31)32)22-8-3-1-4-9-22/h1-12,16,20H,13-15,17-19H2,(H,31,32)