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Substance Name: Disodium 3-((2,2'-dimethyl-4'-((4-((phenylsulphonyl)oxy)phenyl)azo)(1,1'-biphenyl)-4-yl)azo)-4-hydroxynaphthalene-2,7-disulphonate
RN: 6470-38-8
InChIKey: GPUNJJQVDAZQRI-ZZGOUVADSA-L

Molecular Formula

  • C36-H28-N4-O10-S3.2Na

Molecular Weight

  • 816.7974
 
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Names and Synonyms

Synonym

  • EINECS 229-297-7

Systematic Name

  • Disodium 3-((2,2'-dimethyl-4'-((4-((phenylsulphonyl)oxy)phenyl)azo)(1,1'-biphenyl)-4-yl)azo)-4-hydroxynaphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 6470-38-8

System Generated Number

  • 0006470388

Molecular Formulas

Molecular Formula

  • C36-H28-N4-O10-S3.2Na

Molecular Formula Fragments

  • C36-H28-N4-O10-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C36H28N4O10S3.2Na/c1-22-18-26(38-37-25-8-12-28(13-9-25)50-53(48,49)29-6-4-3-5-7-29)10-15-31(22)32-16-11-27(19-23(32)2)39-40-35-34(52(45,46)47)21-24-20-30(51(42,43)44)14-17-33(24)36(35)41;;/h3-21,41H,1-2H3,(H,42,43,44)(H,45,46,47);;/q;2*+1/p-2/b38-37+,40-39+;;

InChIKey

GPUNJJQVDAZQRI-ZZGOUVADSA-L

Smiles

Cc1cc(ccc1c2ccc(cc2C)/N=N/c3c(cc4cc(ccc4c3O)S(=O)(=O)[O-])S(=O)(=O)[O-])/N=N/c5ccc(cc5)OS(=O)(=O)c6ccccc6.[Na+].[Na+]