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Substance Name: Trisodium 5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-((4-methoxyphenyl)amino)-3-sulphonatophenyl)azo)naphthalene-2,7-disulphonate
RN: 73398-42-2
InChIKey: ITTGUFVHVMZQNI-FEISSGSOSA-K

Molecular Formula

  • C26-H19-Cl2-N7-O11-S3.3Na

Molecular Weight

  • 838.5244
 
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Names and Synonyms

Synonym

  • EINECS 277-440-7

Systematic Name

  • Trisodium 5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-((4-methoxyphenyl)amino)-3-sulphonatophenyl)azo)naphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 73398-42-2

System Generated Number

  • 0073398422

Molecular Formulas

Molecular Formula

  • C26-H19-Cl2-N7-O11-S3.3Na

Molecular Formula Fragments

  • C26-H19-Cl2-N7-O11-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C26H19Cl2N7O11S3.3Na/c1-46-15-5-2-13(3-6-15)29-17-7-4-14(10-19(17)48(40,41)42)34-35-22-20(49(43,44)45)9-12-8-16(47(37,38)39)11-18(21(12)23(22)36)30-26-32-24(27)31-25(28)33-26;;;/h2-11,29,36H,1H3,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,30,31,32,33);;;/q;3*+1/p-3/b35-34+;;;

InChIKey

ITTGUFVHVMZQNI-FEISSGSOSA-K

Smiles

COc1ccc(cc1)Nc2ccc(cc2S(=O)(=O)[O-])/N=N/c3c(cc4cc(cc(c4c3O)Nc5nc(nc(n5)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]