Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Trisodium 4-amino-3-((4-(((4-((7-amino-1-hydroxy-3-sulphonato-2-naphthyl)azo)phenyl)amino)carbonyl)phenyl)azo)-5-hydroxy-6-(phenylazo)naphthalene-2,7-disulphonate
RN: 94159-60-1
InChIKey: JARNFPAGYWISTC-RSTATSMGSA-K

Molecular Formula

  • C39-H29-N9-O12-S3.3Na

Molecular Weight

  • 977.8534
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 303-241-2

Systematic Name

  • Trisodium 4-amino-3-((4-(((4-((7-amino-1-hydroxy-3-sulphonato-2-naphthyl)azo)phenyl)amino)carbonyl)phenyl)azo)-5-hydroxy-6-(phenylazo)naphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 94159-60-1

System Generated Number

  • 0094159601

Molecular Formulas

Molecular Formula

  • C39-H29-N9-O12-S3.3Na

Molecular Formula Fragments

  • C39-H29-N9-O12-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C39H29N9O12S3.3Na/c40-23-9-6-21-16-30(62(55,56)57)35(37(49)28(21)19-23)47-45-27-14-12-24(13-15-27)42-39(51)20-7-10-26(11-8-20)44-46-34-29(61(52,53)54)17-22-18-31(63(58,59)60)36(38(50)32(22)33(34)41)48-43-25-4-2-1-3-5-25;;;/h1-19,49-50H,40-41H2,(H,42,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);;;/q;3*+1/p-3/b46-44+,47-45+,48-43+;;;

InChIKey

JARNFPAGYWISTC-RSTATSMGSA-K

Smiles

c1(S(=O)(=O)[O-])c(c(c2c(c(c(S(=O)(=O)[O-])cc2c1)/N=N/c1ccccc1)O)N)/N=N/c1ccc(C(=O)Nc2ccc(/N=N/c3c(S(=O)(=O)[O-])cc4c(c3O)cc(N)cc4)cc2)cc1.[Na+].[Na+].[Na+]