(2R)-2-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-ethanenitrile

Systemtic Name: (2R)-2-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-ethanenitrile Openeye Name: (2R)-2-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-acetonitrile CAS Name: (2R)-2-(4-dimethylaminophenyl)-2-(1-piperazin-4-iumyl)acetonitrile IUPAC Name: (2R)-2-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-ylacetonitrile Traditional Name: (2R)-2-(4-dimethylaminophenyl)-2-piperazin-4-ium-1-yl-acetonitrile Formula: C14H21N4+ MolecularWeight: 245.34334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C#N)N2CC[NH2+]CC2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](C#N)N2CC[NH2+]CC2

InChI

InChI=1S/C14H20N4/c1-17(2)13-5-3-12(4-6-13)14(11-15)18-9-7-16-8-10-18/h3-6,14,16H,7-10H2,1-2H3/p+1/t14-/m0/s1