2-[1-cyclohexyl-4-[4-(2,6-dimethylphenyl)piperidin-1-yl]-1-oxidanyl-butan-2-yl]benzenecarbonitrile

Systemtic Name: 2-[1-cyclohexyl-4-[4-(2,6-dimethylphenyl)piperidin-1-yl]-1-oxidanyl-butan-2-yl]benzenecarbonitrile Openeye Name: 2-[1-[cyclohexyl(hydroxy)methyl]-3-[4-(2,6-dimethylphenyl)-1-piperidyl]propyl]benzonitrile CAS Name: 2-[1-cyclohexyl-4-[4-(2,6-dimethylphenyl)-1-piperidinyl]-1-hydroxybutan-2-yl]benzonitrile IUPAC Name: 2-[1-cyclohexyl-4-[4-(2,6-dimethylphenyl)piperidin-1-yl]-1-hydroxybutan-2-yl]benzonitrile Traditional Name: 2-[1-[cyclohexyl(hydroxy)methyl]-3-[4-(2,6-dimethylphenyl)piperidino]propyl]benzonitrile Formula: C30H40N2O MolecularWeight: 444.6514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2CCN(CC2)CCC(C3=CC=CC=C3C#N)C(C4CCCCC4)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2CCN(CC2)CCC(C3=CC=CC=C3C#N)C(C4CCCCC4)O

InChI

InChI=1S/C30H40N2O/c1-22-9-8-10-23(2)29(22)24-15-18-32(19-16-24)20-17-28(27-14-7-6-13-26(27)21-31)30(33)25-11-4-3-5-12-25/h6-10,13-14,24-25,28,30,33H,3-5,11-12,15-20H2,1-2H3