2-[1,3-benzodioxol-5-yl-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-methyl]sulfanylethanoate

Systemtic Name: 2-[1,3-benzodioxol-5-yl-(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanyl-methyl]sulfanylethanoate Openeye Name: 2-[1,3-benzodioxol-5-yl-(2-oxido-2-oxo-ethyl)sulfanyl-methyl]sulfanylacetate CAS Name: 2-[[1,3-benzodioxol-5-yl-[(2-oxido-2-oxoethyl)thio]methyl]thio]acetate IUPAC Name: 2-[1,3-benzodioxol-5-yl-(2-oxido-2-oxoethyl)sulfanylmethyl]sulfanylacetate Traditional Name: 2-[[1,3-benzodioxol-5-yl-[(2-keto-2-oxido-ethyl)thio]methyl]thio]acetate Formula: C12H10O6S2-2 MolecularWeight: 314.3342

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(SCC(=O)[O-])SCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(SCC(=O)[O-])SCC(=O)[O-]

InChI

InChI=1S/C12H12O6S2/c13-10(14)4-19-12(20-5-11(15)16)7-1-2-8-9(3-7)18-6-17-8/h1-3,12H,4-6H2,(H,13,14)(H,15,16)/p-2