2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-phenyl-ethanamide

Systemtic Name: 2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-phenyl-ethanamide Openeye Name: 2-(3-oxopiperazin-1-ium-1-yl)-N-phenyl-acetamide CAS Name: 2-(3-oxo-1-piperazin-1-iumyl)-N-phenylacetamide IUPAC Name: 2-(3-oxopiperazin-1-ium-1-yl)-N-phenylacetamide Traditional Name: 2-(3-ketopiperazin-1-ium-1-yl)-N-phenyl-acetamide Formula: C12H16N3O2+ MolecularWeight: 234.27434

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H15N3O2/c16-11-8-15(7-6-13-11)9-12(17)14-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,16)(H,14,17)/p+1