N-(4-bromophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-(4-bromophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-(4-bromophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]methanesulfonamide CAS Name: N-(4-bromophenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]methanesulfonamide IUPAC Name: N-(4-bromophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]methanesulfonamide Traditional Name: N-(4-bromophenyl)-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]methanesulfonamide Formula: C14H21BrN3O3S+ MolecularWeight: 391.30384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrN3O3S/c1-16-7-9-17(10-8-16)14(19)11-18(22(2,20)21)13-5-3-12(15)4-6-13/h3-6H,7-11H2,1-2H3/p+1