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Substance Name: 1,3,6-Naphthalenetrisulfonic acid, 5-(2-(4-(2-(4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulfo-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-, sodium salt (1:4)
RN: 70224-59-8
InChIKey: WIKKVJZSTLARBZ-VXLRKHAOSA-J

Molecular Formula

  • C33-H22-Cl-N9-O12-S4.4Na

Molecular Weight

  • 988.233
 
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Names and Synonyms

Synonyms

  • 5-((4-((4-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulfo-1-naphthalenyl)azo)-1-naphthalenyl)azo)-1,3,6-naphthalenetrisulfonic acid, tetrasodium salt
  • EINECS 274-452-4

Systematic Names

  • 1,3,6-Naphthalenetrisulfonic acid, 5-((4-((4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulfo-1-naphthalenyl)azo)-1-naphthalenyl)azo)-, tetrasodium salt
  • 1,3,6-Naphthalenetrisulfonic acid, 5-(2-(4-(2-(4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulfo-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-, sodium salt (1:4)
  • Tetrasodium 5-((4-((4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulphonato-1-naphthyl)azo)-1-naphthyl)azo)naphthalene-1,3,6-trisulphonate

Registry Numbers

CAS Registry Number

  • 70224-59-8

System Generated Number

  • 0070224598

Molecular Formulas

Molecular Formula

  • C33-H22-Cl-N9-O12-S4.4Na

Molecular Formula Fragments

  • C33-H22-Cl-N9-O12-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C33H22ClN9O12S4.4Na/c34-31-37-32(35)39-33(38-31)36-24-8-9-27(22-13-16(56(44,45)46)5-6-20(22)24)41-40-25-10-11-26(19-4-2-1-3-18(19)25)42-43-30-23-14-17(57(47,48)49)15-29(59(53,54)55)21(23)7-12-28(30)58(50,51)52;;;;/h1-15H,(H,44,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H3,35,36,37,38,39);;;;/q;4*+1/p-4/b41-40+,43-42+;;;;

InChIKey

WIKKVJZSTLARBZ-VXLRKHAOSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].c1(cc(cc2c(c(ccc12)S(=O)(=O)[O-])\N=N\c1ccc(c2ccccc12)\N=N\c1ccc(c2ccc(cc12)S(=O)(=O)[O-])Nc1nc(nc(n1)N)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-]