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Substance Name: 3,3'-((3,3'-Dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(5-amino-4-hydroxynaphthalene-2,7-disulphonic) acid, ammonium potassium sodium salt
RN: 93964-43-3
InChIKey: FHVDTQWDURNAOO-WFQXTUNASA-O

Molecular Formula

  • C34-H28-N6-O16-S4.x-H3-N.x-K.x-Na

Molecular Weight

  • 985.0118
 
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Names and Synonyms

Synonym

  • EINECS 300-890-3

Systematic Name

  • 3,3'-((3,3'-Dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(5-amino-4-hydroxynaphthalene-2,7-disulphonic) acid, ammonium potassium sodium salt

Registry Numbers

CAS Registry Number

  • 93964-43-3

System Generated Number

  • 0093964433

Molecular Formulas

Molecular Formula

  • C34-H28-N6-O16-S4.x-H3-N.x-K.x-Na

Molecular Formula Fragments

  • C34-H28-N6-O16-S4
  • COMPONENT
  • H3-N
  • K
  • Na

Structure Descriptors

InChI

1S/C34H28N6O16S4.K.H3N.Na/c1-55-25-9-15(3-5-23(25)37-39-31-27(59(49,50)51)11-17-7-19(57(43,44)45)13-21(35)29(17)33(31)41)16-4-6-24(26(10-16)56-2)38-40-32-28(60(52,53)54)12-18-8-20(58(46,47)48)14-22(36)30(18)34(32)42;;;/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;1H3;/q;+1;;+1/p+1/b39-37+,40-38+;;;

InChIKey

FHVDTQWDURNAOO-WFQXTUNASA-O

Smiles

COc1c(ccc(c1)c2cc(c(cc2)/N=N/c3c(c4c(cc(cc4cc3S(=O)(=O)O)S(=O)(=O)O)N)O)OC)/N=N/c5c(c6c(cc(cc6cc5S(=O)(=O)O)S(=O)(=O)O)N)O.[NH4+].[Na+].[K+]