4-bromanyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]benzenesulfonamide Openeye Name: 4-bromo-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-bromo-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: 4-bromo-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide Formula: C13H19BrN3O3S+ MolecularWeight: 377.27726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18BrN3O3S/c1-16-6-8-17(9-7-16)13(18)10-15-21(19,20)12-4-2-11(14)3-5-12/h2-5,15H,6-10H2,1H3/p+1