N-(2-bromophenyl)-2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]ethanamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2-bromophenyl)acetamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(2-bromophenyl)acetamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2-bromophenyl)acetamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2-bromophenyl)acetamide Formula: C16H22BrN4O3+ MolecularWeight: 398.27488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN4O3/c1-12(22)21-8-6-20(7-9-21)11-16(24)18-10-15(23)19-14-5-3-2-4-13(14)17/h2-5H,6-11H2,1H3,(H,18,24)(H,19,23)/p+1