5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-cyclohexyl-2-phenyl-pentanenitrile

Systemtic Name: 5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-cyclohexyl-2-phenyl-pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-cyclohexyl-2-phenyl-pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-cyclohexyl-2-phenylpentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-cyclohexyl-2-phenylpentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-cyclohexyl-2-phenyl-valeronitrile Formula: C28H35ClN2O MolecularWeight: 451.0433

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C28H35ClN2O/c29-26-14-12-25(13-15-26)28(32)17-20-31(21-18-28)19-7-16-27(22-30,23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1,3-4,8-9,12-15,24,32H,2,5-7,10-11,16-21H2