N-(2-ethyl-6-methyl-phenyl)-2-oxidanylidene-2-piperazin-4-ium-1-yl-ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-oxidanylidene-2-piperazin-4-ium-1-yl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-oxo-2-piperazin-4-ium-1-yl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-oxo-2-(1-piperazin-4-iumyl)acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-oxo-2-piperazin-4-ium-1-ylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-keto-2-piperazin-4-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(=O)N2CC[NH2+]CC2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(=O)N2CC[NH2+]CC2)C

InChI

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