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Substance Name: Cuprate(8-), (mu-((3,3'-(carbonyldiimino)bis(8-(hydroxy-kappaO)-7-(2-(2-(hydroxy-kappaO)-8-hydroxy-3,6-disulfo-1-naphthalenyl)diazenyl-kappaN1)-1,5-naphthalenedisulfonato))(12-)))di-, sodium (1:8)
RN: 72869-84-2
InChIKey: VMHIGETWZMWZMU-RXHDADLPSA-B

Molecular Formula

  • C41-H16-Cu2-N6-O31-S8.8Na

Molecular Weight

  • 1656.13
 
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Names and Synonyms

Synonym

  • 7,7'-(Carbonyldiimino)bis(4-hydroxy-3-((2,8-dihydroxy-3,6-disulfonaphthyl-1)azo)-1,5-naphthalenedisulfonic acid), copper complex, octasodium salt

Systematic Names

  • Cuprate(8-), (mu-((3,3'-(carbonyldiimino)bis(7-((2,8-dihydroxy-3,6-disulfo-1-naphthalenyl)azo)-8-hydroxy-1,5-naphthalenedisulfonato))(12-)))di-, octasodium
  • Cuprate(8-), (mu-((3,3'-(carbonyldiimino)bis(8-(hydroxy-kappaO)-7-((2-(hydroxy-kappaO)-8-hydroxy-3,6-disulfo-1-naphthalenyl)azo-kappaN1)-1,5-naphthalenedisulfonato))(12-)))di-, octasodium
  • Cuprate(8-), (mu-((3,3'-(carbonyldiimino)bis(8-(hydroxy-kappaO)-7-(2-(2-(hydroxy-kappaO)-8-hydroxy-3,6-disulfo-1-naphthalenyl)diazenyl-kappaN1)-1,5-naphthalenedisulfonato))(12-)))di-, sodium (1:8)

Registry Numbers

CAS Registry Number

  • 72869-84-2

System Generated Number

  • 0072869842

Molecular Formulas

Molecular Formula

  • C41-H16-Cu2-N6-O31-S8.8Na

Molecular Formula Fragments

  • C41-H16-Cu2-N6-O31-S8
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C41H28N6O31S8.2Cu.8Na/c48-23-9-17(79(55,56)57)1-13-3-29(85(73,74)75)39(52)35(31(13)23)46-44-21-11-25(81(61,62)63)19-5-15(7-27(83(67,68)69)33(19)37(21)50)42-41(54)43-16-6-20-26(82(64,65)66)12-22(38(51)34(20)28(8-16)84(70,71)72)45-47-36-32-14(4-30(40(36)53)86(76,77)78)2-18(10-24(32)49)80(58,59)60;;;;;;;;;;/h1-12,48-53H,(H2,42,43,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75)(H,76,77,78);;;;;;;;;;/q;2*+2;8*+1/p-12/b46-44+,47-45+;;;;;;;;;;

InChIKey

VMHIGETWZMWZMU-RXHDADLPSA-B

Smiles

[Cu+2].[Na+].Oc1c2c(cc(S([O-])(=O)=O)c1)cc(S([O-])(=O)=O)c([O-])c2\N=N\c1c(c2c(c(S([O-])(=O)=O)c1)cc(NC(Nc1cc3c(S([O-])(=O)=O)cc(\N=N\c4c5c(cc(S([O-])(=O)=O)c4[O-])cc(S([O-])(=O)=O)cc5O)c([O-])c3c(c1)S([O-])(=O)=O)=O)cc2S([O-])(=O)=O)[O-].[Cu+2].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]