disodium; benzene-1,2-diol; 4,5-bis(oxidanyl)benzene-1,3-disulfonate

Systemtic Name: disodium; benzene-1,2-diol; 4,5-bis(oxidanyl)benzene-1,3-disulfonate Openeye Name: disodium; benzene-1,2-diol; 4,5-dihydroxybenzene-1,3-disulfonate CAS Name: disodium; benzene-1,2-diol; 4,5-dihydroxybenzene-1,3-disulfonate IUPAC Name: disodium; benzene-1,2-diol; 4,5-dihydroxybenzene-1,3-disulfonate Traditional Name: disodium; 4,5-dihydroxybenzene-1,3-disulfonate; pyrocatechol Formula: C12H10Na2O10S2 MolecularWeight: 424.31134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)O)O.C1=C(C=C(C(=C1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)O)O.C1=C(C=C(C(=C1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C6H6O8S2.C6H6O2.2Na/c7-4-1-3(15(9,10)11)2-5(6(4)8)16(12,13)14;7-5-3-1-2-4-6(5)8;;/h1-2,7-8H,(H,9,10,11)(H,12,13,14);1-4,7-8H;;/q;;2*+1/p-2