2-[4-(4-ethanoyl-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-(4-ethanoyl-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(4-acetyl-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-(4-acetyl-2-nitrophenyl)-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-(4-acetyl-2-nitrophenyl)piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-(4-acetyl-2-nitro-phenyl)piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C16H23N4O4+ MolecularWeight: 335.37822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O4/c1-12(21)13-4-5-14(15(10-13)20(23)24)19-8-6-18(7-9-19)11-16(22)17(2)3/h4-5,10H,6-9,11H2,1-3H3/p+1