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Substance Name: EINECS 277-757-0
RN: 74196-14-8
InChIKey: XNDRQTDKCKTDPU-IAVFNMDFSA-B

Molecular Formula

  • C46-H20-Fe-N12-O32-S6.9Na

Molecular Weight

  • 1707.867
 
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Names and Synonyms

Results Name

  • EINECS 277-757-0

Synonym

  • EINECS 277-757-0

Systematic Names

  • Ferrate(9-), bis(3-((2-amino-5-(hydroxy-kappaO)-6-((2-(hydroxy-kappaO)-5-nitro-3-sulfophenyl)azo-kappaN1)-7-sulfo-1-naphthalenyl)azo)-2-hydroxy-5-sulfobenzoato(6-))-, nonasodium
  • Ferrate(9-), bis(3-((2-amino-5-hydroxy-6-((2-hydroxy-5-nitro-3-sulfophenyl)azo)-7-sulfo-1-naphthalenyl)azo)-2-hydroxy-5-sulfobenzoato(6-))-, nonasodium
  • Ferrate(9-), bis(3-(2-(2-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-5-nitro-3-sulfophenyl)diazenyl-kappaN1)-7-sulfo-1-naphthalenyl)diazenyl)-2-hydroxy-5-sulfobenzoato(6-))-, sodium (1:9)
  • Nonasodium bis(3-((2-amino-5-hydroxy-6-((2-hydroxy-5-nitro-3-sulphophenyl)azo)-7-sulpho-1-naphthyl)azo)-2-hydroxy-5-sulphobenzoato(6-))ferrate(9-)

Registry Numbers

CAS Registry Number

  • 74196-14-8

System Generated Number

  • 0074196148

Molecular Formulas

Molecular Formula

  • C46-H20-Fe-N12-O32-S6.9Na

Molecular Formula Fragments

  • C46-H20-Fe-N12-O32-S6
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/2C23H16N6O16S3.Fe.9Na/c2*24-13-2-1-10-11(18(13)27-26-15-6-9(46(37,38)39)5-12(20(15)30)23(33)34)7-16(47(40,41)42)19(21(10)31)28-25-14-3-8(29(35)36)4-17(22(14)32)48(43,44)45;;;;;;;;;;/h2*1-7,30-32H,24H2,(H,33,34)(H,37,38,39)(H,40,41,42)(H,43,44,45);;;;;;;;;;/q;;+6;9*+1/p-12/b2*27-26+,28-25+;;;;;;;;;;

InChIKey

XNDRQTDKCKTDPU-IAVFNMDFSA-B

Smiles

[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].Nc1ccc2c3O[Fe-6]456789%10%11%12(OC(=O)c%13cc(cc(N=Nc%14c(N)ccc%15c(O4)c(N=Nc%16cc(cc(c%16O)S(=O)(=O)O5)[N+](=O)[O-])c(cc%14%15)S(=O)(=O)O6)c%13O7)S(=O)(=O)O8)OC(=O)c%17cc(cc(N=Nc1c2cc(c3N=Nc%18cc(cc(c%18O)S(=O)(=O)O9)[N+](=O)[O-])S(=O)(=O)O%10)c%17O%11)S(=O)(=O)O%12