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

Systemtic Name: 2-[2-methyl-4-(phenylmethyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-(4-benzyl-2-methyl-piperazin-1-yl)acetonitrile CAS Name: 2-[2-methyl-4-(phenylmethyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-benzyl-2-methylpiperazin-1-yl)acetonitrile Traditional Name: 2-(4-benzyl-2-methyl-piperazino)acetonitrile Formula: C14H19N3 MolecularWeight: 229.32076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC#N)CC2=CC=CC=C2

Isomeric SMILES

CC1CN(CCN1CC#N)CC2=CC=CC=C2

InChI

InChI=1S/C14H19N3/c1-13-11-16(9-10-17(13)8-7-15)12-14-5-3-2-4-6-14/h2-6,13H,8-12H2,1H3