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Substance Name: (1,1'-Biphenyl)-3,3'-dicarboxylic acid, 4-((4,5-dihydro-3-methyl-5-oxo-1-(6-sulfo-2-naphthalenyl)-1H-pyrazol-4-yl)azo)-4'-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)-, potassium sodium salt
RN: 84100-79-8
InChIKey: ROKYKWOGLMYPNK-KNZLDKEQSA-N

Molecular Formula

  • C39-H31-N7-O11-S.x-K.x-Na

Molecular Weight

  • 867.8659
 
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Names and Synonyms

Synonym

  • EINECS 282-159-8

Systematic Name

  • (1,1'-Biphenyl)-3,3'-dicarboxylic acid, 4-((4,5-dihydro-3-methyl-5-oxo-1-(6-sulfo-2-naphthalenyl)-1H-pyrazol-4-yl)azo)-4'-((1-(((2-methoxyphenyl)amino)carbonyl)-2-oxopropyl)azo)-, potassium sodium salt

Registry Numbers

CAS Registry Number

  • 84100-79-8

System Generated Number

  • 0084100798

Molecular Formulas

Molecular Formula

  • C39-H31-N7-O11-S.x-K.x-Na

Molecular Formula Fragments

  • C39-H31-N7-O11-S
  • COMPONENT
  • K
  • Na

Structure Descriptors

InChI

1S/C39H31N7O11S.K.Na/c1-20-34(37(49)46(45-20)26-12-8-23-17-27(58(54,55)56)13-9-22(23)16-26)43-41-30-14-10-24(18-28(30)38(50)51)25-11-15-31(29(19-25)39(52)53)42-44-35(21(2)47)36(48)40-32-6-4-5-7-33(32)57-3;;/h4-19,34-35H,1-3H3,(H,40,48)(H,50,51)(H,52,53)(H,54,55,56);;/q;2*+1/b43-41+,44-42+;;

InChIKey

ROKYKWOGLMYPNK-KNZLDKEQSA-N

Smiles

CC1=NN(C(=O)C1/N=N/c2ccc(cc2C(=O)O)c3ccc(c(c3)C(=O)O)/N=N/C(C(=O)C)C(=O)Nc4ccccc4OC)c5ccc6cc(ccc6c5)S(=O)(=O)O.[Na+].[K+]