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

Systemtic Name: 5-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-2-phenyl-2-piperidin-1-yl-pentanenitrile Openeye Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-2-phenyl-2-(1-piperidyl)pentanenitrile CAS Name: 5-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-phenyl-2-(1-piperidinyl)pentanenitrile IUPAC Name: 5-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-phenyl-2-piperidin-1-ylpentanenitrile Traditional Name: 5-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-phenyl-2-piperidino-valeronitrile Formula: C27H34ClN3O MolecularWeight: 452.03136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(CCCN2CCC(CC2)(C3=CC=C(C=C3)Cl)O)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C27H34ClN3O/c28-25-12-10-24(11-13-25)27(32)15-20-30(21-16-27)17-7-14-26(22-29,23-8-3-1-4-9-23)31-18-5-2-6-19-31/h1,3-4,8-13,32H,2,5-7,14-21H2