4-[2-(3,5-dimethylpiperidin-1-yl)ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[2-(3,5-dimethylpiperidin-1-yl)ethanoyl]benzenecarbonitrile Openeye Name: 4-[2-(3,5-dimethyl-1-piperidyl)acetyl]benzonitrile CAS Name: 4-[2-(3,5-dimethyl-1-piperidinyl)-1-oxoethyl]benzonitrile IUPAC Name: 4-[2-(3,5-dimethylpiperidin-1-yl)acetyl]benzonitrile Traditional Name: 4-[2-(3,5-dimethylpiperidino)acetyl]benzonitrile Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CC(=O)C2=CC=C(C=C2)C#N)C

Isomeric SMILES

CC1CC(CN(C1)CC(=O)C2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C16H20N2O/c1-12-7-13(2)10-18(9-12)11-16(19)15-5-3-14(8-17)4-6-15/h3-6,12-13H,7,9-11H2,1-2H3