4-[4-(diphenylmethyl)piperazin-1-yl]-1-(3-methoxyphenyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-1-(3-methoxyphenyl)cyclohexane-1-carbonitrile Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-1-(3-methoxyphenyl)cyclohexanecarbonitrile CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-1-(3-methoxyphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-1-(3-methoxyphenyl)cyclohexane-1-carbonitrile Traditional Name: 4-(4-benzhydrylpiperazino)-1-(3-methoxyphenyl)cyclohexanecarbonitrile Formula: C31H35N3O MolecularWeight: 465.6291

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCC(CC2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCC(CC2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C31H35N3O/c1-35-29-14-8-13-27(23-29)31(24-32)17-15-28(16-18-31)33-19-21-34(22-20-33)30(25-9-4-2-5-10-25)26-11-6-3-7-12-26/h2-14,23,28,30H,15-22H2,1H3