[2-sulfanylidene-6-(sulfooxymethyl)-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-yl]methyl hydrogen sulfate

Systemtic Name: [2-sulfanylidene-6-(sulfooxymethyl)-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-yl]methyl hydrogen sulfate Openeye Name: [6-(sulfooxymethyl)-2-thioxo-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-yl]methyl hydrogen sulfate CAS Name: sulfuric acid [2-sulfanylidene-6-(sulfooxymethyl)-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-yl]methyl ester IUPAC Name: [2-sulfanylidene-6-(sulfooxymethyl)-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-yl]methyl hydrogen sulfate Traditional Name: sulfuric acid [6-(sulfoxymethyl)-2-thioxo-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-6-yl]methyl ester Formula: C8H10O8S7 MolecularWeight: 458.6152

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CSC2=C(S1)SC(=S)S2)(COS(=O)(=O)O)COS(=O)(=O)O

Isomeric SMILES

C1C(CSC2=C(S1)SC(=S)S2)(COS(=O)(=O)O)COS(=O)(=O)O

InChI

InChI=1S/C8H10O8S7/c9-22(10,11)15-1-8(2-16-23(12,13)14)3-18-5-6(19-4-8)21-7(17)20-5/h1-4H2,(H,9,10,11)(H,12,13,14)