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

Systemtic Name: N-(4-cyanophenyl)-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-(4-cyanophenyl)-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-(4-cyanophenyl)-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-(4-cyanophenyl)-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-(4-cyanophenyl)-2-piperazin-1-ium-1-yl-acetamide Formula: C13H17N4O+ MolecularWeight: 245.30028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)CC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

C1C[NH+](CCN1)CC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H16N4O/c14-9-11-1-3-12(4-2-11)16-13(18)10-17-7-5-15-6-8-17/h1-4,15H,5-8,10H2,(H,16,18)/p+1