N-(2-cyanophenyl)-2-oxidanylidene-2-piperazin-4-ium-1-yl-ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-oxidanylidene-2-piperazin-4-ium-1-yl-ethanamide Openeye Name: N-(2-cyanophenyl)-2-oxo-2-piperazin-4-ium-1-yl-acetamide CAS Name: N-(2-cyanophenyl)-2-oxo-2-(1-piperazin-4-iumyl)acetamide IUPAC Name: N-(2-cyanophenyl)-2-oxo-2-piperazin-4-ium-1-ylacetamide Traditional Name: N-(2-cyanophenyl)-2-keto-2-piperazin-4-ium-1-yl-acetamide Formula: C13H15N4O2+ MolecularWeight: 259.2838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C13H14N4O2/c14-9-10-3-1-2-4-11(10)16-12(18)13(19)17-7-5-15-6-8-17/h1-4,15H,5-8H2,(H,16,18)/p+1