2,5-dimethoxy-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 2,5-dimethoxy-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]benzenesulfonamide Openeye Name: 2,5-dimethoxy-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]benzenesulfonamide CAS Name: 2,5-dimethoxy-N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 2,5-dimethoxy-N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]benzenesulfonamide Traditional Name: 2,5-dimethoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]benzenesulfonamide Formula: C20H28N3O4S+ MolecularWeight: 406.51902

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNS(=O)(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNS(=O)(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C20H27N3O4S/c1-22-10-12-23(13-11-22)17-6-4-16(5-7-17)15-21-28(24,25)20-14-18(26-2)8-9-19(20)27-3/h4-9,14,21H,10-13,15H2,1-3H3/p+1