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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCC3=C2SSC3=S)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

COC1=C(C=C2C(=C1)CCC3=C2SSC3=S)S(=O)(=O)[O-].[Na+]

InChI

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