4-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethoxy]benzenesulfonamide

Systemtic Name: 4-[2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylethoxy]benzenesulfonamide CAS Name: 4-[2-[(1-oxido-2-pyridin-1-iumyl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(1-oxidopyridin-1-ium-2-yl)sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[(1-oxidopyridin-1-ium-2-yl)thio]ethoxy]benzenesulfonamide Formula: C13H14N2O4S2 MolecularWeight: 326.39126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCCOC2=CC=C(C=C2)S(=O)(=O)N)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCCOC2=CC=C(C=C2)S(=O)(=O)N)[O-]

InChI

InChI=1S/C13H14N2O4S2/c14-21(17,18)12-6-4-11(5-7-12)19-9-10-20-13-3-1-2-8-15(13)16/h1-8H,9-10H2,(H2,14,17,18)