Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Tetrasodium 3-((4-((4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulphonato-1-naphthyl)azo)-7-sulphonato-1-naphthyl)azo)naphthalene-1,5-disulphonate
RN: 84434-58-2
InChIKey: BFGORUIXPULGPD-VXLRKHAOSA-J

Molecular Formula

  • C33-H22-Cl-N9-O12-S4.4Na

Molecular Weight

  • 988.2332
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 282-858-8

Systematic Name

  • Tetrasodium 3-((4-((4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-7-sulphonato-1-naphthyl)azo)-7-sulphonato-1-naphthyl)azo)naphthalene-1,5-disulphonate

Registry Numbers

CAS Registry Number

  • 84434-58-2

System Generated Number

  • 0084434582

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)36-25-8-9-28(22-14-17(56(44,45)46)4-6-19(22)25)43-42-26-10-11-27(23-15-18(57(47,48)49)5-7-20(23)26)41-40-16-12-24-21(30(13-16)59(53,54)55)2-1-3-29(24)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

BFGORUIXPULGPD-VXLRKHAOSA-J

Smiles

c1cc2c(cc(cc2S(=O)(=O)[O-])/N=N/c3ccc(c4c3cc(cc4)S(=O)(=O)[O-])/N=N/c5ccc(c6c5cc(cc6)S(=O)(=O)[O-])Nc7nc(nc(n7)Cl)N)c(c1)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]