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Substance Name: Sodium 4-(4-((3-(anilinosulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-2,5-dichlorobenzenesulphonate
RN: 6359-99-5
InChIKey: HKTOCEMTZDAQKB-JGUILPGDSA-M

Molecular Formula

  • C23-H19-Cl2-N5-O6-S2.Na

Molecular Weight

  • 618.4522
 
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Names and Synonyms

Synonym

  • EINECS 228-820-6

Systematic Name

  • Sodium 4-(4-((3-(anilinosulphonyl)-p-tolyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-2,5-dichlorobenzenesulphonate

Registry Numbers

CAS Registry Number

  • 6359-99-5

System Generated Number

  • 0006359995

Molecular Formulas

Molecular Formula

  • C23-H19-Cl2-N5-O6-S2.Na

Molecular Formula Fragments

  • C23-H19-Cl2-N5-O6-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C23H19Cl2N5O6S2.Na/c1-13-8-9-16(10-20(13)37(32,33)29-15-6-4-3-5-7-15)26-27-22-14(2)28-30(23(22)31)19-11-18(25)21(12-17(19)24)38(34,35)36;/h3-12,22,29H,1-2H3,(H,34,35,36);/q;+1/p-1/b27-26+;

InChIKey

HKTOCEMTZDAQKB-JGUILPGDSA-M

Smiles

Cc1ccc(cc1S(=O)(=O)Nc2ccccc2)/N=N/C3C(=NN(C3=O)c4cc(c(cc4Cl)S(=O)(=O)[O-])Cl)C.[Na+]