N-(2-ethyl-6-methyl-phenyl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O2/c1-3-12-6-4-5-11(2)15(12)17-14(20)10-18-8-7-16-13(19)9-18/h4-6H,3,7-10H2,1-2H3,(H,16,19)(H,17,20)/p+1