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

Systemtic Name: 1,3-bis(bromanyl)benzo[f][2]benzothiole-5-sulfonic acid Openeye Name: 1,3-dibromobenzo[f][2]benzothiole-5-sulfonic acid CAS Name: 1,3-dibromo-5-benzo[f][2]benzothiolesulfonic acid IUPAC Name: 1,3-dibromobenzo[f][2]benzothiole-5-sulfonic acid Traditional Name: 1,3-dibromobenz[f]isobenzothiophene-5-sulfonic acid Formula: C12H6Br2O3S2 MolecularWeight: 422.11224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=C(SC(=C3C=C2C(=C1)S(=O)(=O)O)Br)Br

Isomeric SMILES

C1=CC2=CC3=C(SC(=C3C=C2C(=C1)S(=O)(=O)O)Br)Br

InChI

InChI=1S/C12H6Br2O3S2/c13-11-8-4-6-2-1-3-10(19(15,16)17)7(6)5-9(8)12(14)18-11/h1-5H,(H,15,16,17)