4-[[4-(4-methoxyphenyl)-4-(3-methylphenyl)piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4-methoxyphenyl)-4-(3-methylphenyl)piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4-methoxyphenyl)-4-(m-tolyl)-1-piperidyl]methyl]benzonitrile CAS Name: 4-[[4-(4-methoxyphenyl)-4-(3-methylphenyl)-1-piperidinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4-methoxyphenyl)-4-(3-methylphenyl)piperidin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(4-methoxyphenyl)-4-(m-tolyl)piperidino]methyl]benzonitrile Formula: C27H28N2O MolecularWeight: 396.52402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2(CCN(CC2)CC3=CC=C(C=C3)C#N)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2(CCN(CC2)CC3=CC=C(C=C3)C#N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H28N2O/c1-21-4-3-5-25(18-21)27(24-10-12-26(30-2)13-11-24)14-16-29(17-15-27)20-23-8-6-22(19-28)7-9-23/h3-13,18H,14-17,20H2,1-2H3