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Substance Name: p-(4,5-Dihydro-4-((2-methoxy-5-methyl-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid, potassium sodium salt
RN: 85567-08-4
InChIKey: ZHIOWXPPOBTFIF-ZPZFBZIMSA-N

Molecular Formula

  • C20-H22-N4-O11-S3.x-K.x-Na

Molecular Weight

  • 652.6968
 
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Names and Synonyms

Synonym

  • EINECS 287-720-0

Systematic Names

  • Benzenesulfonic acid, 4-(4,5-dihydro-4-((2-methoxy-5-methyl-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)-, potassium sodium salt
  • p-(4,5-Dihydro-4-((2-methoxy-5-methyl-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid, potassium sodium salt

Registry Numbers

CAS Registry Number

  • 85567-08-4

System Generated Number

  • 0085567084

Molecular Formulas

Molecular Formula

  • C20-H22-N4-O11-S3.x-K.x-Na

Molecular Formula Fragments

  • C20-H22-N4-O11-S3
  • COMPONENT
  • K
  • Na

Structure Descriptors

InChI

1S/C20H22N4O11S3.K.Na/c1-12-10-16(17(34-3)11-18(12)36(26,27)9-8-35-38(31,32)33)21-22-19-13(2)23-24(20(19)25)14-4-6-15(7-5-14)37(28,29)30;;/h4-7,10-11,19H,8-9H2,1-3H3,(H,28,29,30)(H,31,32,33);;/q;2*+1/b22-21+;;

InChIKey

ZHIOWXPPOBTFIF-ZPZFBZIMSA-N

Smiles

[Na+].[K+].COc1cc(c(C)cc1N=NC2C(=NN(C2=O)c3ccc(cc3)S(=O)(=O)O)C)S(=O)(=O)CCOS(=O)(=O)O