N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C14H10F2N2O4S MolecularWeight: 340.302006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC(=O)NC2=CC3=C(C=C2)OC(O3)(F)F)[O-]

InChI

InChI=1S/C14H10F2N2O4S/c15-14(16)21-10-5-4-9(7-11(10)22-14)17-12(19)8-23-13-3-1-2-6-18(13)20/h1-7H,8H2,(H,17,19)