N-butyl-3-chloranyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]benzenesulfonamide

Systemtic Name: N-butyl-3-chloranyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]benzenesulfonamide Openeye Name: N-butyl-3-chloro-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]benzenesulfonamide CAS Name: N-butyl-3-chloro-4-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]benzenesulfonamide IUPAC Name: N-butyl-3-chloro-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]benzenesulfonamide Traditional Name: N-butyl-3-chloro-4-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]benzenesulfonamide Formula: C17H27ClN3O4S+ MolecularWeight: 404.93198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CC[NH+](CC2)C)Cl

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)N2CC[NH+](CC2)C)Cl

InChI

InChI=1S/C17H26ClN3O4S/c1-3-4-7-19-26(23,24)14-5-6-16(15(18)12-14)25-13-17(22)21-10-8-20(2)9-11-21/h5-6,12,19H,3-4,7-11,13H2,1-2H3/p+1