N-(2-ethylphenyl)-2-[2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanoylamino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-(3-oxopiperazin-1-ium-1-yl)acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[1-oxo-2-(3-oxo-1-piperazin-1-iumyl)ethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-(3-oxopiperazin-1-ium-1-yl)acetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-(3-ketopiperazin-1-ium-1-yl)acetyl]amino]acetamide Formula: C16H23N4O3+ MolecularWeight: 319.37882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCNC(=O)C2

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCNC(=O)C2

InChI

InChI=1S/C16H22N4O3/c1-2-12-5-3-4-6-13(12)19-14(21)9-18-16(23)11-20-8-7-17-15(22)10-20/h3-6H,2,7-11H2,1H3,(H,17,22)(H,18,23)(H,19,21)/p+1