2-[2-methyl-4-(phenylcarbonyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[2-methyl-4-(phenylcarbonyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-(4-benzoyl-2-methyl-piperazin-1-yl)acetonitrile CAS Name: 2-(4-benzoyl-2-methyl-1-piperazinyl)acetonitrile IUPAC Name: 2-(4-benzoyl-2-methylpiperazin-1-yl)acetonitrile Traditional Name: 2-(4-benzoyl-2-methyl-piperazino)acetonitrile Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1CN(CCN1CC#N)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H17N3O/c1-12-11-17(10-9-16(12)8-7-15)14(18)13-5-3-2-4-6-13/h2-6,12H,8-11H2,1H3