dipotassium [2,3-bis(bromanyl)-4-(hydroxymethyl)-6-sulfonatooxy-phenyl] sulfate

Systemtic Name: dipotassium [2,3-bis(bromanyl)-4-(hydroxymethyl)-6-sulfonatooxy-phenyl] sulfate Openeye Name: dipotassium [2,3-dibromo-4-(hydroxymethyl)-6-sulfonatooxy-phenyl] sulfate CAS Name: dipotassium [2,3-dibromo-4-(hydroxymethyl)-6-sulfonatooxyphenyl] sulfate IUPAC Name: dipotassium [2,3-dibromo-4-(hydroxymethyl)-6-sulfonatooxyphenyl] sulfate Traditional Name: dipotassium (2,3-dibromo-4-methylol-6-sulfato-phenyl) sulfate Formula: C7H4Br2K2O9S2 MolecularWeight: 534.23586

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1OS(=O)(=O)[O-])OS(=O)(=O)[O-])Br)Br)CO.[K+].[K+]

Isomeric SMILES

C1=C(C(=C(C(=C1OS(=O)(=O)[O-])OS(=O)(=O)[O-])Br)Br)CO.[K+].[K+]

InChI

InChI=1S/C7H6Br2O9S2.2K/c8-5-3(2-10)1-4(17-19(11,12)13)7(6(5)9)18-20(14,15)16;;/h1,10H,2H2,(H,11,12,13)(H,14,15,16);;/q;2*+1/p-2