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Substance Name: Disodium 6-((2-(4-cyclohexylphenoxy)phenyl)azo)-4-(((2,4-dichlorophenoxy)acetyl)amino)-5-hydroxynaphthalene-1,7-disulphonate
RN: 83027-51-4
InChIKey: BHQMXPXVOJJXEW-GDXDGRBBSA-L

Molecular Formula

  • C36-H31-Cl2-N3-O10-S2.2Na

Molecular Weight

  • 844.6541
 
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Names and Synonyms

Synonym

  • EINECS 280-155-0

Systematic Names

  • 1,7-Naphthalenedisulfonic acid, 6-((2-(4-cyclohexylphenoxy)phenyl)azo)-4-(((2,4-dichlorophenoxy)acetyl)amino)-5-hydroxy-, disodium salt
  • Disodium 6-((2-(4-cyclohexylphenoxy)phenyl)azo)-4-(((2,4-dichlorophenoxy)acetyl)amino)-5-hydroxynaphthalene-1,7-disulphonate

Registry Numbers

CAS Registry Number

  • 83027-51-4

System Generated Number

  • 0083027514

Molecular Formulas

Molecular Formula

  • C36-H31-Cl2-N3-O10-S2.2Na

Molecular Formula Fragments

  • C36-H31-Cl2-N3-O10-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C36H31Cl2N3O10S2.2Na/c37-23-12-16-29(26(38)18-23)50-20-33(42)39-28-15-17-31(52(44,45)46)25-19-32(53(47,48)49)35(36(43)34(25)28)41-40-27-8-4-5-9-30(27)51-24-13-10-22(11-14-24)21-6-2-1-3-7-21;;/h4-5,8-19,21,43H,1-3,6-7,20H2,(H,39,42)(H,44,45,46)(H,47,48,49);;/q;2*+1/p-2/b41-40+;;

InChIKey

BHQMXPXVOJJXEW-GDXDGRBBSA-L

Smiles

c1ccc(c(c1)/N=N/c2c(cc3c(ccc(c3c2O)NC(=O)COc4ccc(cc4Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])Oc5ccc(cc5)C6CCCCC6.[Na+].[Na+]