sodium 5-[5,7-bis(oxidanyl)-4-oxidanylidene-chromen-3-yl]-2-oxidanyl-benzenesulfonate

Systemtic Name: sodium 5-[5,7-bis(oxidanyl)-4-oxidanylidene-chromen-3-yl]-2-oxidanyl-benzenesulfonate Openeye Name: sodium 5-(5,7-dihydroxy-4-oxo-chromen-3-yl)-2-hydroxy-benzenesulfonate CAS Name: sodium 5-(5,7-dihydroxy-4-oxo-1-benzopyran-3-yl)-2-hydroxybenzenesulfonate IUPAC Name: sodium 5-(5,7-dihydroxy-4-oxochromen-3-yl)-2-hydroxybenzenesulfonate Traditional Name: sodium 5-(5,7-dihydroxy-4-keto-chromen-3-yl)-2-hydroxy-besylate Formula: C15H9NaO8S MolecularWeight: 372.28193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)S(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)S(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C15H10O8S.Na/c16-8-4-11(18)14-12(5-8)23-6-9(15(14)19)7-1-2-10(17)13(3-7)24(20,21)22;/h1-6,16-18H,(H,20,21,22);/q;+1/p-1