2-(4-bromophenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(4-bromophenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(4-bromophenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(4-bromophenyl)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(4-bromophenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(4-bromophenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C13H18BrN2O+ MolecularWeight: 298.19882

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CC2=CC=C(C=C2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H17BrN2O/c1-15-6-8-16(9-7-15)13(17)10-11-2-4-12(14)5-3-11/h2-5H,6-10H2,1H3/p+1