1,3-bis(bromanyl)-5,7-dimethoxy-benzo[f][2]benzothiole-6-sulfonic acid

Systemtic Name: 1,3-bis(bromanyl)-5,7-dimethoxy-benzo[f][2]benzothiole-6-sulfonic acid Openeye Name: 1,3-dibromo-5,7-dimethoxy-benzo[f][2]benzothiole-6-sulfonic acid CAS Name: 1,3-dibromo-5,7-dimethoxy-6-benzo[f][2]benzothiolesulfonic acid IUPAC Name: 1,3-dibromo-5,7-dimethoxybenzo[f][2]benzothiole-6-sulfonic acid Traditional Name: 1,3-dibromo-5,7-dimethoxy-benz[f]isobenzothiophene-6-sulfonic acid Formula: C14H10Br2O5S2 MolecularWeight: 482.1642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=C(SC(=C3C=C2C(=C1S(=O)(=O)O)OC)Br)Br

Isomeric SMILES

COC1=CC2=CC3=C(SC(=C3C=C2C(=C1S(=O)(=O)O)OC)Br)Br

InChI

InChI=1S/C14H10Br2O5S2/c1-20-10-4-6-3-8-9(14(16)22-13(8)15)5-7(6)11(21-2)12(10)23(17,18)19/h3-5H,1-2H3,(H,17,18,19)