N-phenyl-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-phenyl-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-phenyl-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-phenyl-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-phenyl-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-phenyl-2-piperazin-1-ium-1-yl-acetamide Formula: C12H18N3O+ MolecularWeight: 220.29082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O/c16-12(10-15-8-6-13-7-9-15)14-11-4-2-1-3-5-11/h1-5,13H,6-10H2,(H,14,16)/p+1