trisodium 2,3-bis(oxidanyl)benzenesulfonate

Systemtic Name: trisodium 2,3-bis(oxidanyl)benzenesulfonate Openeye Name: trisodium 2,3-dihydroxybenzenesulfonate CAS Name: trisodium 2,3-dihydroxybenzenesulfonate IUPAC Name: trisodium 2,3-dihydroxybenzenesulfonate Traditional Name: trisodium 2,3-dihydroxybesylate Formula: C18H15Na3O15S3 MolecularWeight: 636.46701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C6H6O5S.3Na/c3*7-4-2-1-3-5(6(4)8)12(9,10)11;;;/h3*1-3,7-8H,(H,9,10,11);;;/q;;;3*+1/p-3