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Substance Name: 2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-((2-methoxyphenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-((6-sulfo-2-naphthalenyl)azo)-, sodium salt, compd. with 2,2'-(methylimino)bis(ethanol)
RN: 83763-86-4
InChIKey: IALXZMLMHQXAFG-ZTJYFDIRSA-K

Molecular Formula

  • C38-H28-N6-O13-S3.x-C5-H13-N-O2.x-Na

Molecular Weight

  • 1057.9752
 
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Names and Synonyms

Synonym

  • EINECS 280-775-1

Systematic Name

  • 2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-((2-methoxyphenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-((6-sulfo-2-naphthalenyl)azo)-, sodium salt, compd. with 2,2'-(methylimino)bis(ethanol)

Registry Numbers

CAS Registry Number

  • 83763-86-4

System Generated Number

  • 0083763864

Molecular Formulas

Molecular Formula

  • C38-H28-N6-O13-S3.x-C5-H13-N-O2.x-Na

Molecular Formula Fragments

  • C38-H28-N6-O13-S3
  • C5-H13-N-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H28N6O13S3.C5H13NO2.3Na/c1-57-31-5-3-2-4-30(31)42-44-35-33(60(54,55)56)19-23-16-25(10-13-29(23)37(35)46)40-38(47)39-24-9-12-28-22(15-24)18-32(59(51,52)53)34(36(28)45)43-41-26-8-6-21-17-27(58(48,49)50)11-7-20(21)14-26;1-6(2-4-7)3-5-8;;;/h2-19,45-46H,1H3,(H2,39,40,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);7-8H,2-5H2,1H3;;;/q;;3*+1/p-3/b43-41+,44-42+;;;;

InChIKey

IALXZMLMHQXAFG-ZTJYFDIRSA-K

Smiles

CN(CCO)CCO.COc1ccccc1/N=N/c2c(cc3cc(ccc3c2O)NC(=O)Nc4ccc5c(c4)cc(c(c5O)/N=N/c6ccc7cc(ccc7c6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]