sodium 8-methoxy-3-sulfanylidene-4,5-dihydrobenzo[g][1,2]benzodithiole-7-sulfonate

Systemtic Name: sodium 8-methoxy-3-sulfanylidene-4,5-dihydrobenzo[g][1,2]benzodithiole-7-sulfonate Openeye Name: sodium 8-methoxy-3-thioxo-4,5-dihydrobenzo[g][1,2]benzodithiole-7-sulfonate CAS Name: sodium 8-methoxy-3-sulfanylidene-4,5-dihydrobenzo[g][1,2]benzodithiole-7-sulfonate IUPAC Name: sodium 8-methoxy-3-sulfanylidene-4,5-dihydrobenzo[g][1,2]benzodithiole-7-sulfonate Traditional Name: sodium 8-methoxy-3-thioxo-4,5-dihydrobenzo[g][1,2]benzodithiole-7-sulfonate Formula: C12H9NaO4S4 MolecularWeight: 368.44723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCC3=C(C2=C1)SSC3=S)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=C2CCC3=C(C2=C1)SSC3=S)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H10O4S4.Na/c1-16-9-5-8-6(4-10(9)20(13,14)15)2-3-7-11(8)18-19-12(7)17;/h4-5H,2-3H2,1H3,(H,13,14,15);/q;+1/p-1