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Substance Name: 5-((4-Chloro-6-phenylamino-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-6-sulfophenyl)azo)-2,7-naphthalenedisulfonic acid
RN: 73287-61-3
InChIKey: RUYHWXYGLUTLJB-JEIPZWNWSA-N

Molecular Formula

  • C27-H22-Cl-N7-O10-S3

Molecular Weight

  • 736.1608
 
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Names and Synonyms

Name of Substance

  • 5-((4-Chloro-6-phenylamino-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-6-sulfophenyl)azo)-2,7-naphthalenedisulfonic acid

Synonym

  • ADS J2

Systematic Names

  • 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-2-sulfophenyl)azo)-
  • 2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methyl-2-sulfophenyl)diazenyl)-

Registry Numbers

CAS Registry Number

  • 73287-61-3

System Generated Number

  • 0073287613

Structure Descriptors

InChI

1S/C27H22ClN7O10S3/c1-14-8-9-18(20(10-14)47(40,41)42)33-34-23-21(48(43,44)45)12-15-11-17(46(37,38)39)13-19(22(15)24(23)36)29-26-30-25(28)31-27(32-26)35(2)16-6-4-3-5-7-16/h3-13,36H,1-2H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,29,30,31,32)/b34-33+

InChIKey

RUYHWXYGLUTLJB-JEIPZWNWSA-N

Smiles

Cc1ccc(c(c1)S(=O)(=O)O)/N=N/c2c(cc3cc(cc(c3c2O)Nc4nc(nc(n4)Cl)N(C)c5ccccc5)S(=O)(=O)O)S(=O)(=O)O