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Substance Name: Tetrasodium 5-((4-chloro-6-((4-sulphonatophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((1-sulphonato-2-naphthyl)azo)naphthalene-2,7-disulphonate
RN: 41555-86-6
InChIKey: CQYNHQJBIFPZPH-RTBGNPICSA-J

Molecular Formula

  • C29-H20-Cl-N7-O13-S4.4Na

Molecular Weight

  • 926.1584
 
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Names and Synonyms

Synonym

  • EINECS 255-436-6

Systematic Name

  • Tetrasodium 5-((4-chloro-6-((4-sulphonatophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((1-sulphonato-2-naphthyl)azo)naphthalene-2,7-disulphonate

Registry Numbers

CAS Registry Number

  • 41555-86-6

System Generated Number

  • 0041555866

Molecular Formulas

Molecular Formula

  • C29-H20-Cl-N7-O13-S4.4Na

Molecular Formula Fragments

  • C29-H20-Cl-N7-O13-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H20ClN7O13S4.4Na/c30-27-33-28(31-16-6-8-17(9-7-16)51(39,40)41)35-29(34-27)32-21-13-18(52(42,43)44)11-15-12-22(53(45,46)47)24(25(38)23(15)21)37-36-20-10-5-14-3-1-2-4-19(14)26(20)54(48,49)50;;;;/h1-13,38H,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)(H2,31,32,33,34,35);;;;/q;4*+1/p-4/b37-36+;;;;

InChIKey

CQYNHQJBIFPZPH-RTBGNPICSA-J

Smiles

c1ccc2c(c1)ccc(c2S(=O)(=O)[O-])/N=N/c3c(cc4cc(cc(c4c3O)Nc5nc(nc(n5)Cl)Nc6ccc(cc6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]