sodium 2,5-bis(oxidanyl)benzenesulfonate dibenzoate

Systemtic Name: sodium 2,5-bis(oxidanyl)benzenesulfonate dibenzoate Openeye Name: sodium 2,5-dihydroxybenzenesulfonate dibenzoate CAS Name: sodium 2,5-dihydroxybenzenesulfonate dibenzoate IUPAC Name: sodium 2,5-dihydroxybenzenesulfonate dibenzoate Traditional Name: sodium 2,5-dihydroxybesylate dibenzoate Formula: C20H15NaO9S-2 MolecularWeight: 454.38247

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC(=C(C=C1O)S(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/2C7H6O2.C6H6O5S.Na/c2*8-7(9)6-4-2-1-3-5-6;7-4-1-2-5(8)6(3-4)12(9,10)11;/h2*1-5H,(H,8,9);1-3,7-8H,(H,9,10,11);/q;;;+1/p-3