2-fluoranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]benzenesulfonamide

Systemtic Name: 2-fluoranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]benzenesulfonamide Openeye Name: 2-fluoro-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]benzenesulfonamide CAS Name: 2-fluoro-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]benzenesulfonamide IUPAC Name: 2-fluoro-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]benzenesulfonamide Traditional Name: 2-fluoro-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]benzenesulfonamide Formula: C17H21FN3O4S2+ MolecularWeight: 414.494743

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C17H20FN3O4S2/c1-20-10-12-21(13-11-20)27(24,25)15-8-6-14(7-9-15)19-26(22,23)17-5-3-2-4-16(17)18/h2-9,19H,10-13H2,1H3/p+1