N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-fluoro-benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-fluorobenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-fluorobenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-fluoro-benzenesulfonamide Formula: C18H23FN3O2S+ MolecularWeight: 364.457523

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C18H22FN3O2S/c1-2-21-10-12-22(13-11-21)18-9-4-3-8-17(18)20-25(23,24)16-7-5-6-15(19)14-16/h3-9,14,20H,2,10-13H2,1H3/p+1