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Substance Name: Tetrasodium 5-(acetamido)-3-((4-((4-((8-(acetamido)-1-hydroxy-3,6-disulphonato-2-naphthyl)azo)-5-methoxy-o-tolyl)azo)phenyl)azo)-4-hydroxynaphthalene-2,7-disulphonate
RN: 84560-10-1
InChIKey: JQWSULBBHWHBEU-APOQPMLQSA-J

Molecular Formula

  • C38-H32-N8-O17-S4.4Na

Molecular Weight

  • 1088.9022
 
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Names and Synonyms

Synonym

  • EINECS 283-198-3

Systematic Name

  • Tetrasodium 5-(acetamido)-3-((4-((4-((8-(acetamido)-1-hydroxy-3,6-disulphonato-2-naphthyl)azo)-5-methoxy-o-tolyl)azo)phenyl)azo)-4-hydroxynaphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 84560-10-1

System Generated Number

  • 0084560101

Molecular Formulas

Molecular Formula

  • C38-H32-N8-O17-S4.4Na

Molecular Formula Fragments

  • C38-H32-N8-O17-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H32N8O17S4.4Na/c1-17-9-27(44-46-36-32(67(60,61)62)13-21-11-25(65(54,55)56)15-29(40-19(3)48)34(21)38(36)50)30(63-4)16-26(17)43-41-22-5-7-23(8-6-22)42-45-35-31(66(57,58)59)12-20-10-24(64(51,52)53)14-28(39-18(2)47)33(20)37(35)49;;;;/h5-16,49-50H,1-4H3,(H,39,47)(H,40,48)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);;;;/q;4*+1/p-4/b43-41+,45-42+,46-44+;;;;

InChIKey

JQWSULBBHWHBEU-APOQPMLQSA-J

Smiles

Cc1cc(c(cc1/N=N/c2ccc(cc2)/N=N/c3c(cc4cc(cc(c4c3O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)/N=N/c5c(cc6cc(cc(c6c5O)NC(=O)C)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]