2-(1-cyclohexylpiperidin-4-yl)-2-[4-(4-methoxyphenyl)carbonylphenyl]ethanenitrile

Systemtic Name: 2-(1-cyclohexylpiperidin-4-yl)-2-[4-(4-methoxyphenyl)carbonylphenyl]ethanenitrile Openeye Name: 2-(1-cyclohexyl-4-piperidyl)-2-[4-(4-methoxybenzoyl)phenyl]acetonitrile CAS Name: 2-(1-cyclohexyl-4-piperidinyl)-2-[4-[(4-methoxyphenyl)-oxomethyl]phenyl]acetonitrile IUPAC Name: 2-(1-cyclohexylpiperidin-4-yl)-2-[4-(4-methoxybenzoyl)phenyl]acetonitrile Traditional Name: 2-(1-cyclohexyl-4-piperidyl)-2-(4-p-anisoylphenyl)acetonitrile Formula: C27H32N2O2 MolecularWeight: 416.55518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(C#N)C3CCN(CC3)C4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(C#N)C3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C27H32N2O2/c1-31-25-13-11-23(12-14-25)27(30)22-9-7-20(8-10-22)26(19-28)21-15-17-29(18-16-21)24-5-3-2-4-6-24/h7-14,21,24,26H,2-6,15-18H2,1H3