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Substance Name: Tetrasodium 2-((6-((4-chloro-6-((4-sulphonatophenyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3-sulphonato-2-naphthyl)azo)benzene-1,4-disulphonate
RN: 94042-75-8
InChIKey: SGFKIFOYZRJSKP-QKELVUDESA-J

Molecular Formula

  • C25-H18-Cl-N7-O13-S4.4Na

Molecular Weight

  • 876.0986
 
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Names and Synonyms

Synonym

  • EINECS 301-741-5

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 94042-75-8

System Generated Number

  • 0094042758

Molecular Formulas

Molecular Formula

  • C25-H18-Cl-N7-O13-S4.4Na

Molecular Formula Fragments

  • C25-H18-Cl-N7-O13-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C25H18ClN7O13S4.4Na/c26-23-29-24(27-13-1-4-15(5-2-13)47(35,36)37)31-25(30-23)28-14-3-7-17-12(9-14)10-20(50(44,45)46)21(22(17)34)33-32-18-11-16(48(38,39)40)6-8-19(18)49(41,42)43;;;;/h1-11,34H,(H,35,36,37)(H,38,39,40)(H,41,42,43)(H,44,45,46)(H2,27,28,29,30,31);;;;/q;4*+1/p-4/b33-32+;;;;

InChIKey

SGFKIFOYZRJSKP-QKELVUDESA-J

Smiles

c1(S(=O)(=O)[O-])c(/N=N/c2c(S(=O)(=O)[O-])ccc(S(=O)(=O)[O-])c2)c(c2c(c1)cc(Nc1nc(nc(n1)Cl)Nc1ccc(S(=O)(=O)[O-])cc1)cc2)O.[Na+].[Na+].[Na+].[Na+]