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Substance Name: EINECS 259-806-8
RN: 55772-05-9
InChIKey: ALKRMTFICZQUIM-UHFFFAOYSA-N

Molecular Formula

  • C37-H30-Cl2-N8-O10-S3

Molecular Weight

  • 913.794
 
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Names and Synonyms

Results Name

  • EINECS 259-806-8

Synonym

  • EINECS 259-806-8

Systematic Names

  • Dihydrogen 3-((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-2-sulphonatophenyl)amino)-7-(ethyl((3-sulphonatophenyl)methyl)amino)-5-(4-methoxy-3-sulphonatophenyl)phenazinium
  • Phenazinium, 3-((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-2-sulfophenyl)amino)-7-(ethyl((3-sulfophenyl)methyl)amino)-5-(4-methoxy-3-sulfophenyl)-, hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 55772-05-9

System Generated Number

  • 0055772059

Structure Descriptors

InChI

1S/C37H30Cl2N8O10S3/c1-3-46(20-21-5-4-6-26(15-21)58(48,49)50)24-9-13-28-31(18-24)47(25-10-14-32(57-2)34(19-25)60(54,55)56)30-16-22(7-11-27(30)42-28)40-29-12-8-23(17-33(29)59(51,52)53)41-37-44-35(38)43-36(39)45-37/h4-19H,3,20H2,1-2H3,(H4,41,42,43,44,45,48,49,50,51,52,53,54,55,56)

InChIKey

ALKRMTFICZQUIM-UHFFFAOYSA-N

Smiles

CCN(Cc1cccc(c1)S(=O)(=O)O)c2ccc3c(c2)[n+](c4cc(ccc4n3)Nc5ccc(cc5S(=O)(=O)O)Nc6nc(nc(n6)Cl)Cl)c7ccc(c(c7)S(=O)(=O)[O-])OC