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Substance Name: Chromate(5-), bis(5-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-2,7-naphthalenedisulfonato(4-))-, sodium hydrogen (1:4:1)
RN: 68132-92-3
InChIKey: QDCWFADDCWIOPO-KFKLQTDTSA-G

Molecular Formula

  • C40-H20-Cl2-Cr-N14-O22-S4.H.4Na

Molecular Weight

  • 1392.81
 
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Names and Synonyms

Synonym

  • EINECS 268-656-2

Systematic Names

  • Chromate(5-), bis(5-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-2,7-naphthalenedisulfonato(4-))-, sodium hydrogen (1:4:1)
  • Chromate(5-), bis(5-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)-2,7-naphthalenedisulfonato(4-))-, tetrasodium hydrogen
  • Tetrasodium hydrogen bis(5-((4-chloro-6-methoxy-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)naphthalene-2,7-disulphonato(4-))chromate(5-)

Registry Numbers

CAS Registry Number

  • 68132-92-3

System Generated Number

  • 0068132923

Molecular Formulas

Molecular Formula

  • C40-H20-Cl2-Cr-N14-O22-S4.H.4Na

Molecular Formula Fragments

  • C40-H20-Cl2-Cr-N14-O22-S4
  • COMPONENT
  • H
  • Na

Structure Descriptors

InChI

1S/2C20H14ClN7O11S2.Cr.4Na/c2*1-39-20-24-18(21)23-19(25-20)22-12-7-10(40(33,34)35)4-8-5-14(41(36,37)38)16(17(30)15(8)12)27-26-11-6-9(28(31)32)2-3-13(11)29;;;;;/h2*2-7,29-30H,1H3,(H,33,34,35)(H,36,37,38)(H,22,23,24,25);;;;;/q;;+3;4*+1/p-7/b2*27-26+;;;;;

InChIKey

QDCWFADDCWIOPO-KFKLQTDTSA-G

Smiles

[Na+].[Cr+3].c1(c(c(c2c(c1)cc(S(=O)(=O)[O-])cc2Nc1nc(nc(n1)OC)Cl)[O-])\N=N\c1cc([N+]([O-])=O)ccc1[O-])S(=O)(=O)[O-].c1(S(=O)(=O)[O-])c(\N=N\c2cc(ccc2[O-])[N+]([O-])=O)c(c2c(c1)cc(cc2Nc1nc(nc(n1)OC)Cl)S(=O)(=O)[O-])[O-].[Na+].[Na+].[Na+]