4-[[4-(2,4-dimethylphenyl)carbonylpiperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2,4-dimethylphenyl)carbonylpiperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2,4-dimethylbenzoyl)-1-piperidyl]methyl]benzonitrile CAS Name: 4-[[4-[(2,4-dimethylphenyl)-oxomethyl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2,4-dimethylbenzoyl)piperidin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2,4-dimethylbenzoyl)piperidino]methyl]benzonitrile Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C22H24N2O/c1-16-3-8-21(17(2)13-16)22(25)20-9-11-24(12-10-20)15-19-6-4-18(14-23)5-7-19/h3-8,13,20H,9-12,15H2,1-2H3