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Substance Name: 3-((2,5-Dimethoxy-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)-4-hydroxy-6-((sulphophenyl)amino)naphthalene-2-sulphonic acid, potassium sodium salt
RN: 85614-39-7
InChIKey: AAQURDAYBQZBFG-NTDCDQSISA-N

Molecular Formula

  • C26-H25-N3-O15-S4.x-Na.x-K

Molecular Weight

  • 809.8415
 
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Names and Synonyms

Synonym

  • EINECS 287-925-5

Systematic Name

  • 3-((2,5-Dimethoxy-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)-4-hydroxy-6-((sulphophenyl)amino)naphthalene-2-sulphonic acid, potassium sodium salt

Registry Numbers

CAS Registry Number

  • 85614-39-7

System Generated Number

  • 0085614397

Molecular Formulas

Molecular Formula

  • C26-H25-N3-O15-S4.x-Na.x-K

Molecular Formula Fragments

  • C26-H25-N3-O15-S4
  • COMPONENT
  • K
  • Na

Structure Descriptors

InChI

1S/C26H25N3O15S4.K.Na/c1-42-20-14-23(45(31,32)10-9-44-48(39,40)41)21(43-2)13-19(20)28-29-25-24(47(36,37)38)11-15-7-8-16(12-17(15)26(25)30)27-18-5-3-4-6-22(18)46(33,34)35;;/h3-8,11-14,27,30H,9-10H2,1-2H3,(H,33,34,35)(H,36,37,38)(H,39,40,41);;/q;2*+1/b29-28+;;

InChIKey

AAQURDAYBQZBFG-NTDCDQSISA-N

Smiles

[Na+].[K+].COc1cc(c(OC)cc1N=Nc2c(O)c3cc(Nc4ccccc4S(=O)(=O)O)ccc3cc2S(=O)(=O)O)S(=O)(=O)CCOS(=O)(=O)O