3-bromanyl-4-methoxy-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-4-methoxy-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzenesulfonamide Openeye Name: 3-bromo-4-methoxy-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzenesulfonamide CAS Name: 3-bromo-4-methoxy-N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]benzenesulfonamide IUPAC Name: 3-bromo-4-methoxy-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzenesulfonamide Traditional Name: 3-bromo-4-methoxy-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzenesulfonamide Formula: C15H25BrN3O3S+ MolecularWeight: 407.3463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24BrN3O3S/c1-18-8-10-19(11-9-18)7-3-6-17-23(20,21)13-4-5-15(22-2)14(16)12-13/h4-5,12,17H,3,6-11H2,1-2H3/p+1