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Substance Name: Dipotassium 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)benzene-1,3-disulphonate
RN: 84434-49-1
InChIKey: AKODATABYORSTB-GDXDGRBBSA-L

Molecular Formula

  • C33-H39-Cl-N8-O10-S2.2K

Molecular Weight

  • 883.4823
 
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Names and Synonyms

Synonym

  • EINECS 282-848-3

Systematic Name

  • Dipotassium 4-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)azo)-6-((4-chloro-6-(4-nonylphenoxy)-1,3,5-triazin-2-yl)amino)benzene-1,3-disulphonate

Registry Numbers

CAS Registry Number

  • 84434-49-1

System Generated Number

  • 0084434491

Molecular Formulas

Molecular Formula

  • C33-H39-Cl-N8-O10-S2.2K

Molecular Formula Fragments

  • C33-H39-Cl-N8-O10-S2
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C33H39ClN8O10S2.2K/c1-4-6-7-8-9-10-11-12-20-13-15-21(16-14-20)52-33-38-31(34)37-32(39-33)36-22-17-23(25(54(49,50)51)18-24(22)53(46,47)48)40-41-27-19(3)26(28(35)43)29(44)42(5-2)30(27)45;;/h13-18,45H,4-12H2,1-3H3,(H2,35,43)(H,46,47,48)(H,49,50,51)(H,36,37,38,39);;/q;2*+1/p-2/b41-40+;;

InChIKey

AKODATABYORSTB-GDXDGRBBSA-L

Smiles

CCCCCCCCCc1ccc(cc1)Oc2nc(nc(n2)Cl)Nc3cc(c(cc3S(=O)(=O)[O-])S(=O)(=O)[O-])/N=N/c4c(c(c(=O)n(c4O)CC)C(=O)N)C.[K+].[K+]