Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Disodium 2'-(4-((1-hydroxy-7-(phenylamino)-3-sulphonato-2-naphthyl)azo)phenyl)-6-methyl(2,6'-bibenzothiazole)-7-sulphonate
RN: 6222-60-2
InChIKey: BXXXGQSNYKDLCV-NZWRDQTFSA-L

Molecular Formula

  • C37-H25-N5-O7-S4.2Na

Molecular Weight

  • 823.8607
 
* 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 228-306-1

Systematic Name

  • Disodium 2'-(4-((1-hydroxy-7-(phenylamino)-3-sulphonato-2-naphthyl)azo)phenyl)-6-methyl(2,6'-bibenzothiazole)-7-sulphonate

Registry Numbers

CAS Registry Number

  • 6222-60-2

System Generated Number

  • 0006222602

Molecular Formulas

Molecular Formula

  • C37-H25-N5-O7-S4.2Na

Molecular Formula Fragments

  • C37-H25-N5-O7-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C37H25N5O7S4.2Na/c1-20-7-15-29-34(35(20)53(47,48)49)51-37(40-29)23-11-16-28-30(17-23)50-36(39-28)21-8-12-25(13-9-21)41-42-32-31(52(44,45)46)18-22-10-14-26(19-27(22)33(32)43)38-24-5-3-2-4-6-24;;/h2-19,38,43H,1H3,(H,44,45,46)(H,47,48,49);;/q;2*+1/p-2/b42-41+;;

InChIKey

BXXXGQSNYKDLCV-NZWRDQTFSA-L

Smiles

c1(S(=O)(=O)[O-])c(/N=N/c2ccc(c3nc4c(s3)cc(c3sc5c(S(=O)(=O)[O-])c(ccc5n3)C)cc4)cc2)c(c2c(c1)ccc(c2)Nc1ccccc1)O.[Na+].[Na+]