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

Systemtic Name: N-(2-ethanoylphenyl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-acetylphenyl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-acetylphenyl)-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2-acetylphenyl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-acetylphenyl)-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C14H18N3O3+ MolecularWeight: 276.31102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCNC(=O)C2

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCNC(=O)C2

InChI

InChI=1S/C14H17N3O3/c1-10(18)11-4-2-3-5-12(11)16-14(20)9-17-7-6-15-13(19)8-17/h2-5H,6-9H2,1H3,(H,15,19)(H,16,20)/p+1