4-fluoranyl-N-(3-piperazin-4-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-(3-piperazin-4-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 4-fluoro-N-(3-piperazin-4-ium-1-ylpropyl)benzenesulfonamide CAS Name: 4-fluoro-N-[3-(1-piperazin-4-iumyl)propyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-(3-piperazin-4-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 4-fluoro-N-(3-piperazin-4-ium-1-ylpropyl)benzenesulfonamide Formula: C13H21FN3O2S+ MolecularWeight: 302.388143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCCNS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1CN(CC[NH2+]1)CCCNS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H20FN3O2S/c14-12-2-4-13(5-3-12)20(18,19)16-6-1-9-17-10-7-15-8-11-17/h2-5,15-16H,1,6-11H2/p+1