5,7-dimethoxy-1,3-dihydrobenzo[f][2]benzothiole-6-sulfonic acid

Systemtic Name: 5,7-dimethoxy-1,3-dihydrobenzo[f][2]benzothiole-6-sulfonic acid Openeye Name: 5,7-dimethoxy-1,3-dihydrobenzo[f][2]benzothiole-6-sulfonic acid CAS Name: 5,7-dimethoxy-1,3-dihydrobenzo[f][2]benzothiole-6-sulfonic acid IUPAC Name: 5,7-dimethoxy-1,3-dihydrobenzo[f][2]benzothiole-6-sulfonic acid Traditional Name: 5,7-dimethoxy-1,3-dihydrobenz[f]isobenzothiophene-6-sulfonic acid Formula: C14H14O5S2 MolecularWeight: 326.38796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=C(CSC3)C=C2C(=C1S(=O)(=O)O)OC

Isomeric SMILES

COC1=CC2=CC3=C(CSC3)C=C2C(=C1S(=O)(=O)O)OC

InChI

InChI=1S/C14H14O5S2/c1-18-12-5-8-3-9-6-20-7-10(9)4-11(8)13(19-2)14(12)21(15,16)17/h3-5H,6-7H2,1-2H3,(H,15,16,17)