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

Systemtic Name: 4-fluoranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide CAS Name: 4-fluoro-N-[2-(4-methyl-1-piperazin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]benzenesulfonamide Formula: C13H21FN3O2S+ MolecularWeight: 302.388143

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCNS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C[NH+]1CCN(CC1)CCNS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H20FN3O2S/c1-16-8-10-17(11-9-16)7-6-15-20(18,19)13-4-2-12(14)3-5-13/h2-5,15H,6-11H2,1H3/p+1