4-[4-(2-methyl-2-oxidanyl-propyl)piperazin-1-yl]-1-phenyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(2-methyl-2-oxidanyl-propyl)piperazin-1-yl]-1-phenyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(2-hydroxy-2-methyl-propyl)piperazin-1-yl]-1-phenyl-cyclohexanecarbonitrile CAS Name: 4-[4-(2-hydroxy-2-methylpropyl)-1-piperazinyl]-1-phenyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]-1-phenylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(2-hydroxy-2-methyl-propyl)piperazino]-1-phenyl-cyclohexanecarbonitrile Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCN(CC1)C2CCC(CC2)(C#N)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(CN1CCN(CC1)C2CCC(CC2)(C#N)C3=CC=CC=C3)O

InChI

InChI=1S/C21H31N3O/c1-20(2,25)17-23-12-14-24(15-13-23)19-8-10-21(16-22,11-9-19)18-6-4-3-5-7-18/h3-7,19,25H,8-15,17H2,1-2H3