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Substance Name: 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methyl-2-sulfophenyl)diazenyl)-, sodium salt (1:4)
RN: 75150-16-2
InChIKey: CKPVPFDQXPWGPO-ULDVOPSXSA-N

Molecular Formula

  • C28-H24-Cl-N7-O16-S5.4Na

Molecular Weight

  • 910.3136
 
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Names and Synonyms

  • 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-2-sulfophenyl)azo)-, tetrasodium salt
  • 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-((4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methyl-2-sulfophenyl)diazenyl)-, sodium salt (1:4)

Registry Numbers

CAS Registry Number

  • 75150-16-2

System Generated Number

  • 0075150162

Molecular Formulas

Molecular Formula

  • C28-H24-Cl-N7-O16-S5.4Na

Molecular Formula Fragments

  • C28-H24-Cl-N7-O16-S5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C28H24ClN7O16S5/c1-14-2-7-19(21(10-14)55(43,44)45)35-36-24-22(56(46,47)48)12-15-11-18(54(40,41)42)13-20(23(15)25(24)37)31-28-33-26(29)32-27(34-28)30-16-3-5-17(6-4-16)53(38,39)9-8-52-57(49,50)51/h2-7,10-13,37H,8-9H2,1H3,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H,49,50,51)(H2,30,31,32,33,34)/b36-35+

InChIKey

CKPVPFDQXPWGPO-ULDVOPSXSA-N

Smiles

Cc1ccc(c(c1)S(=O)(=O)O)/N=N/c2c(cc3cc(cc(c3c2O)Nc4nc(nc(n4)Cl)Nc5ccc(cc5)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O