4-[4-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]piperazin-1-yl]-1-phenyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-[2-(4-chlorophenyl)-2-oxidanyl-ethyl]piperazin-1-yl]-1-phenyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-[2-(4-chlorophenyl)-2-hydroxy-ethyl]piperazin-1-yl]-1-phenyl-cyclohexanecarbonitrile CAS Name: 4-[4-[2-(4-chlorophenyl)-2-hydroxyethyl]-1-piperazinyl]-1-phenyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-[2-(4-chlorophenyl)-2-hydroxyethyl]piperazin-1-yl]-1-phenylcyclohexane-1-carbonitrile Traditional Name: 4-[4-[2-(4-chlorophenyl)-2-hydroxy-ethyl]piperazino]-1-phenyl-cyclohexanecarbonitrile Formula: C25H30ClN3O MolecularWeight: 423.9782

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2CCN(CC2)CC(C3=CC=C(C=C3)Cl)O)(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1N2CCN(CC2)CC(C3=CC=C(C=C3)Cl)O)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H30ClN3O/c26-22-8-6-20(7-9-22)24(30)18-28-14-16-29(17-15-28)23-10-12-25(19-27,13-11-23)21-4-2-1-3-5-21/h1-9,23-24,30H,10-18H2