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sodium 3-[2,4-bis(oxidanyl)phenyl]carbonylbenzenesulfonate

sodium 3-[2,4-bis(oxidanyl)phenyl]carbonylbenzenesulfonate

Systemtic Name:sodium 3-[2,4-bis(oxidanyl)phenyl]carbonylbenzenesulfonate
Openeye Name:sodium 3-(2,4-dihydroxybenzoyl)benzenesulfonate
CAS Name:sodium 3-[(2,4-dihydroxyphenyl)-oxomethyl]benzenesulfonate
IUPAC Name:sodium 3-(2,4-dihydroxybenzoyl)benzenesulfonate
Traditional Name:sodium 3-(2,4-dihydroxybenzoyl)besylate
Formula: C13H9NaO6S
MolecularWeight: 316.26173
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)C2=C(C=C(C=C2)O)O.[Na+]


Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)C2=C(C=C(C=C2)O)O.[Na+]


InChI

InChI=1S/C13H10O6S.Na/c14-9-4-5-11(12(15)7-9)13(16)8-2-1-3-10(6-8)20(17,18)19;/h1-7,14-15H,(H,17,18,19);/q;+1/p-1


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