sodium 3,5-bis(bromanyl)-4-oxidanyl-benzenesulfonate

Systemtic Name: sodium 3,5-bis(bromanyl)-4-oxidanyl-benzenesulfonate Openeye Name: sodium 3,5-dibromo-4-hydroxy-benzenesulfonate CAS Name: sodium 3,5-dibromo-4-hydroxybenzenesulfonate IUPAC Name: sodium 3,5-dibromo-4-hydroxybenzenesulfonate Traditional Name: sodium 3,5-dibromo-4-hydroxy-besylate Formula: C6H3Br2NaO4S MolecularWeight: 353.94839

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)O)Br)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=C(C=C(C(=C1Br)O)Br)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C6H4Br2O4S.Na/c7-4-1-3(13(10,11)12)2-5(8)6(4)9;/h1-2,9H,(H,10,11,12);/q;+1/p-1