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Substance Name: Cuprate(4-), (mu-((7,7'-((6-chloro-1,3,5-triazine-2,6-diyl)diimino)bis(3-((3-chloro-2-hydroxy-5-sulfophenyl)azo)-4-hydroxy-2-naphthalenesulfonato))(8-)))di-, tetrasodium
RN: 85269-53-0
InChIKey: LBGQIBLRBAZZMR-AWRASWHNSA-F

Molecular Formula

  • C35-H14-Cl3-Cu2-N9-O16-S4.4Na

Molecular Weight

  • 1270.2176
 
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Names and Synonyms

  • Cuprate(4-), (mu-((7,7'-((6-chloro-1,3,5-triazine-2,6-diyl)diimino)bis(3-((3-chloro-2-hydroxy-5-sulfophenyl)azo)-4-hydroxy-2-naphthalenesulfonato))(8-)))di-, tetrasodium

Registry Numbers

CAS Registry Number

  • 85269-53-0

System Generated Number

  • 0085269530

Molecular Formulas

Molecular Formula

  • C35-H14-Cl3-Cu2-N9-O16-S4.4Na

Molecular Formula Fragments

  • C35-H14-Cl3-Cu2-N9-O16-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C35H22Cl3N9O16S4.2Cu.4Na/c36-21-9-17(64(52,53)54)11-23(31(21)50)44-46-27-25(66(58,59)60)7-13-5-15(1-3-19(13)29(27)48)39-34-41-33(38)42-35(43-34)40-16-2-4-20-14(6-16)8-26(67(61,62)63)28(30(20)49)47-45-24-12-18(65(55,56)57)10-22(37)32(24)51;;;;;;/h1-12,48-51H,(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H2,39,40,41,42,43);;;;;;/q;2*+2;4*+1/p-8/b46-44+,47-45+;;;;;;

InChIKey

LBGQIBLRBAZZMR-AWRASWHNSA-F

Smiles

[Na+].[Na+].[Na+].[Na+].Clc1cc2cc3N=Nc4c5O[Cu-2](Oc13)(OS2(=O)=O)OS(=O)(=O)c4cc6cc(Nc7nc(Cl)nc(Nc8ccc9c%10O[Cu-2]%11%12Oc%13c(Cl)cc(cc%13N=Nc%10c(cc9c8)S(=O)(=O)O%11)S(=O)(=O)O%12)n7)ccc56