2-(3-methylphenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile hydrochloride

Systemtic Name: 2-(3-methylphenyl)-2-(4-methylpiperazin-1-yl)ethanenitrile hydrochloride Openeye Name: 2-(4-methylpiperazin-1-yl)-2-(m-tolyl)acetonitrile hydrochloride CAS Name: 2-(3-methylphenyl)-2-(4-methyl-1-piperazinyl)acetonitrile hydrochloride IUPAC Name: 2-(3-methylphenyl)-2-(4-methylpiperazin-1-yl)acetonitrile hydrochloride Traditional Name: 2-(4-methylpiperazino)-2-(m-tolyl)acetonitrile hydrochloride Formula: C14H20ClN3 MolecularWeight: 265.7817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C#N)N2CCN(CC2)C.Cl

Isomeric SMILES

CC1=CC(=CC=C1)C(C#N)N2CCN(CC2)C.Cl

InChI

InChI=1S/C14H19N3.ClH/c1-12-4-3-5-13(10-12)14(11-15)17-8-6-16(2)7-9-17;/h3-5,10,14H,6-9H2,1-2H3;1H