4-fluoranyl-N-(pyridin-1-ium-4-ylmethyl)benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-(pyridin-1-ium-4-ylmethyl)benzenesulfonamide Openeye Name: 4-fluoro-N-(pyridin-1-ium-4-ylmethyl)benzenesulfonamide CAS Name: 4-fluoro-N-(4-pyridin-1-iumylmethyl)benzenesulfonamide IUPAC Name: 4-fluoro-N-(pyridin-1-ium-4-ylmethyl)benzenesulfonamide Traditional Name: 4-fluoro-N-(pyridin-1-ium-4-ylmethyl)benzenesulfonamide Formula: C12H12FN2O2S+ MolecularWeight: 267.299283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)S(=O)(=O)NCC2=CC=[NH+]C=C2

Isomeric SMILES

C1=CC(=CC=C1F)S(=O)(=O)NCC2=CC=[NH+]C=C2

InChI

InChI=1S/C12H11FN2O2S/c13-11-1-3-12(4-2-11)18(16,17)15-9-10-5-7-14-8-6-10/h1-8,15H,9H2/p+1