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Substance Name: EINECS 274-399-7
RN: 70210-01-4
InChIKey: GPTGXGSVAYWNAM-ZRCOUJIOSA-K

Molecular Formula

  • C29-H21-Br2-N5-O13-S3.3Na

Molecular Weight

  • 969.459
 
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Names and Synonyms

Results Name

  • EINECS 274-399-7

Synonyms

  • 2,7-Naphthalenedisulfonic acid, 5-((3-((2-bromo-1-oxo-2-propenyl)amino)benzoyl)amino)-3-((5-((2-bromo-1-oxo-2-propenyl)amino)-2-sulfophenyl)azo)-4-hydroxy-, trisodium salt
  • EINECS 274-399-7

Systematic Names

  • 2,7-Naphthalenedisulfonic acid, 5-((3-((2-bromo-1-oxo-2-propen-1-yl)amino)benzoyl)amino)-3-(2-(5-((2-bromo-1-oxo-2-propen-1-yl)amino)-2-sulfophenyl)diazenyl)-4-hydroxy-, sodium salt (1:3)
  • 2,7-Naphthalenedisulfonic acid, 5-((3-((2-bromo-1-oxo-2-propenyl)amino)benzoyl)amino)-3-((5-((2-bromo-1-oxo-2-propenyl)amino)-2-sulfophenyl)azo)-4-hydroxy-, trisodium salt
  • Trisodium 5-((3-((2-bromo-1-oxoallyl)amino)benzoyl)amino)-3-((5-((2-bromo-1-oxoallyl)amino)-2-sulphonatophenyl)azo)-4-hydroxynaphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 70210-01-4

System Generated Number

  • 0070210014

Molecular Formulas

Molecular Formula

  • C29-H21-Br2-N5-O13-S3.3Na

Molecular Formula Fragments

  • C29-H21-Br2-N5-O13-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H21Br2N5O13S3.3Na/c1-13(30)27(38)32-17-5-3-4-15(8-17)29(40)34-21-12-19(50(41,42)43)9-16-10-23(52(47,48)49)25(26(37)24(16)21)36-35-20-11-18(33-28(39)14(2)31)6-7-22(20)51(44,45)46;;;/h3-12,37H,1-2H2,(H,32,38)(H,33,39)(H,34,40)(H,41,42,43)(H,44,45,46)(H,47,48,49);;;/q;3*+1/p-3/b36-35+;;;

InChIKey

GPTGXGSVAYWNAM-ZRCOUJIOSA-K

Smiles

[Na+].[Na+].[Na+].c1c(c(c(c2c(cc(cc12)S(=O)(=O)[O-])NC(c1cc(ccc1)NC(C(=C)Br)=O)=O)O)\N=N\c1c(ccc(c1)NC(C(=C)Br)=O)S(=O)(=O)[O-])S(=O)(=O)[O-]