N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-(4-ethanoylpiperazin-1-ium-1-yl)-N-methyl-ethanamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-(4-ethanoylpiperazin-1-ium-1-yl)-N-methyl-ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(2-bromoanilino)-2-oxo-ethyl]-N-methyl-acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-[2-(2-bromoanilino)-2-oxoethyl]-N-methylacetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(2-bromoanilino)-2-oxoethyl]-N-methylacetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-[2-(2-bromoanilino)-2-keto-ethyl]-N-methyl-acetamide Formula: C17H24BrN4O3+ MolecularWeight: 412.30146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)N(C)CC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)N(C)CC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C17H23BrN4O3/c1-13(23)22-9-7-21(8-10-22)12-17(25)20(2)11-16(24)19-15-6-4-3-5-14(15)18/h3-6H,7-12H2,1-2H3,(H,19,24)/p+1