(3-oxidanyl-4,6-disulfo-2-sulfonatooxy-phenoxy) sulfate

Systemtic Name: (3-oxidanyl-4,6-disulfo-2-sulfonatooxy-phenoxy) sulfate Openeye Name: (3-hydroxy-4,6-disulfo-2-sulfonatooxy-phenoxy) sulfate CAS Name: (2-hydroxy-3,5-disulfo-6-sulfonatodioxyphenyl) sulfate IUPAC Name: (3-hydroxy-4,6-disulfo-2-sulfonatooxyphenoxy) sulfate Traditional Name: (2-hydroxy-3,5-disulfo-6-sulfonatoperoxy-phenyl) sulfate Formula: C6H4O16S4-2 MolecularWeight: 460.34636

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1S(=O)(=O)O)OOS(=O)(=O)[O-])OS(=O)(=O)[O-])O)S(=O)(=O)O

Isomeric SMILES

C1=C(C(=C(C(=C1S(=O)(=O)O)OOS(=O)(=O)[O-])OS(=O)(=O)[O-])O)S(=O)(=O)O

InChI

InChI=1S/C6H6O16S4/c7-4-2(23(8,9)10)1-3(24(11,12)13)5(20-22-26(17,18)19)6(4)21-25(14,15)16/h1,7H,(H,8,9,10)(H,11,12,13)(H,14,15,16)(H,17,18,19)/p-2