disodium [3,4-bis(oxidanyl)-5-phosphonato-phenyl]phosphonic acid

Systemtic Name: disodium [3,4-bis(oxidanyl)-5-phosphonato-phenyl]phosphonic acid Openeye Name: disodium (3,4-dihydroxy-5-phosphonato-phenyl)phosphonic acid CAS Name: disodium (3,4-dihydroxy-5-phosphonatophenyl)phosphonic acid IUPAC Name: disodium (3,4-dihydroxy-5-phosphonatophenyl)phosphonic acid Traditional Name: disodium (3,4-dihydroxy-5-phosphonato-phenyl)phosphonic acid Formula: C6H6Na2O8P2 MolecularWeight: 314.034102

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1P(=O)([O-])[O-])O)O)P(=O)(O)O.[Na+].[Na+]

Isomeric SMILES

C1=C(C=C(C(=C1P(=O)([O-])[O-])O)O)P(=O)(O)O.[Na+].[Na+]

InChI

InChI=1S/C6H8O8P2.2Na/c7-4-1-3(15(9,10)11)2-5(6(4)8)16(12,13)14;;/h1-2,7-8H,(H2,9,10,11)(H2,12,13,14);;/q;2*+1/p-2