disodium 1-oxidanyl-2-oxidanylidene-2-[4-[4-(2-oxidanyl-2-sulfonato-ethanoyl)phenyl]phenyl]ethanesulfonate

Systemtic Name: disodium 1-oxidanyl-2-oxidanylidene-2-[4-[4-(2-oxidanyl-2-sulfonato-ethanoyl)phenyl]phenyl]ethanesulfonate Openeye Name: disodium 1-hydroxy-2-[4-[4-(2-hydroxy-2-sulfonato-acetyl)phenyl]phenyl]-2-oxo-ethanesulfonate CAS Name: disodium 1-hydroxy-2-[4-[4-(2-hydroxy-1-oxo-2-sulfonatoethyl)phenyl]phenyl]-2-oxoethanesulfonate IUPAC Name: disodium 1-hydroxy-2-[4-[4-(2-hydroxy-2-sulfonatoacetyl)phenyl]phenyl]-2-oxoethanesulfonate Traditional Name: disodium 1-hydroxy-2-[4-[4-(2-hydroxy-2-sulfonato-acetyl)phenyl]phenyl]-2-keto-ethanesulfonate Formula: C16H12Na2O10S2 MolecularWeight: 474.37002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)C(O)S(=O)(=O)[O-])C(=O)C(O)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)C(O)S(=O)(=O)[O-])C(=O)C(O)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C16H14O10S2.2Na/c17-13(15(19)27(21,22)23)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(18)16(20)28(24,25)26;;/h1-8,15-16,19-20H,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2