Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 4-((4-((3-(2-(8-amino-7-(2-(2,5-disulfophenyl)diazenyl)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:5)
RN: 68133-30-2
InChIKey: FGLNKPIAQFNZKB-WBPYBQPFSA-I

Molecular Formula

  • C32-H23-Cl-N10-O18-S5.5Na

Molecular Weight

  • 1141.2792
 
* 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

  • 4-((4-((3-((8-Amino-1-hydroxy-3,6-disulfo-7-((2,5-disulfophenyl)azo)-2-naphthalenyl)azo)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)benzoic acid, pentasodium salt

Systematic Names

  • Benzoic acid, 4-((4-((3-((8-amino-7-((2,5-disulfophenyl)azo)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-, pentasodium salt
  • Benzoic acid, 4-((4-((3-(2-(8-amino-7-(2-(2,5-disulfophenyl)diazenyl)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-4-sulfophenyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-, sodium salt (1:5)

Registry Numbers

CAS Registry Number

  • 68133-30-2

System Generated Number

  • 0068133302

Molecular Formulas

Molecular Formula

  • C32-H23-Cl-N10-O18-S5.5Na

Molecular Formula Fragments

  • C32-H23-Cl-N10-O18-S5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C32H23ClN10O18S5.5Na/c33-30-37-31(35-15-3-1-13(2-4-15)29(45)46)39-32(38-30)36-16-5-7-20(63(50,51)52)18(11-16)40-43-27-23(66(59,60)61)10-14-9-22(65(56,57)58)26(25(34)24(14)28(27)44)42-41-19-12-17(62(47,48)49)6-8-21(19)64(53,54)55;;;;;/h1-12,44H,34H2,(H,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H,56,57,58)(H,59,60,61)(H2,35,36,37,38,39);;;;;/q;5*+1/p-5/b42-41+,43-40+;;;;;

InChIKey

FGLNKPIAQFNZKB-WBPYBQPFSA-I

Smiles

c1cc(ccc1C(=O)[O-])Nc2nc(nc(n2)Cl)Nc3ccc(c(c3)/N=N/c4c(cc5cc(c(c(c5c4O)N)/N=N/c6cc(ccc6S(=O)(=O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]