4,5-bis(iodanyl)-2,3-bis(oxidanyl)-6-(phenylcarbonyl)benzenesulfonic acid

Systemtic Name: 4,5-bis(iodanyl)-2,3-bis(oxidanyl)-6-(phenylcarbonyl)benzenesulfonic acid Openeye Name: 2-benzoyl-5,6-dihydroxy-3,4-diiodo-benzenesulfonic acid CAS Name: 2-benzoyl-5,6-dihydroxy-3,4-diiodobenzenesulfonic acid IUPAC Name: 2-benzoyl-5,6-dihydroxy-3,4-diiodobenzenesulfonic acid Traditional Name: 2-benzoyl-5,6-dihydroxy-3,4-diiodo-besylic acid Formula: C13H8I2O6S MolecularWeight: 546.07296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C(=C(C(=C2I)I)O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C(=C(C(=C2I)I)O)O)S(=O)(=O)O

InChI

InChI=1S/C13H8I2O6S/c14-8-7(10(16)6-4-2-1-3-5-6)13(22(19,20)21)12(18)11(17)9(8)15/h1-5,17-18H,(H,19,20,21)