4-fluoranyl-N-(2-oxidanylidene-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-(2-oxidanylidene-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide Openeye Name: 4-fluoro-N-(2-oxo-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide CAS Name: 4-fluoro-N-[2-oxo-2-(1-piperazin-4-iumyl)ethyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-(2-oxo-2-piperazin-4-ium-1-ylethyl)benzenesulfonamide Traditional Name: 4-fluoro-N-(2-keto-2-piperazin-4-ium-1-yl-ethyl)benzenesulfonamide Formula: C12H17FN3O3S+ MolecularWeight: 302.345083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16FN3O3S/c13-10-1-3-11(4-2-10)20(18,19)15-9-12(17)16-7-5-14-6-8-16/h1-4,14-15H,5-9H2/p+1