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Substance Name: Cuprate(3-), (mu-(4-(2-(3,3'-di(hydroxy-kappaO)-4'-(2-(1-(hydroxy-kappaO)-6-(phenylamino)-3-sulfo-2-naphthalenyl)diazenyl-kappaN1)(1,1'-biphenyl)-4-yl)diazenyl-kappaN1)-3-(hydroxy-kappaO)-2,7-naphthalenedisulfonato(7-)))di-, sodium (1:3)
RN: 68140-37-4
InChIKey: PGLVXPZSWHWUIY-YJJIRTMLSA-G

Molecular Formula

  • C38-H20-Cu2-N5-O13-S3.3Na

Molecular Weight

  • 1046.86
 
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Names and Synonyms

  • Cuprate(3-), (mu-(4-((3,3'-di(hydroxy-kappaO)-4'-((1-(hydroxy-kappaO)-6-(phenylamino)-3-sulfo-2-naphthalenyl)azo-kappaN1)(1,1'-biphenyl)-4-yl)azo-kappaN1)-3-(hydroxy-kappaO)-2,7-naphthalenedisulfonato(7-)))di-, trisodium
  • Cuprate(3-), (mu-(4-((3,3'-dihydroxy-4'-((1-hydroxy-6-(phenylamino)-3-sulfo-2-naphthalenyl)azo)(1,1'-biphenyl)-4-yl)azo)-3-hydroxy-2,7-naphthalenedisulfonato(7-)))di-, trisodium
  • Cuprate(3-), (mu-(4-(2-(3,3'-di(hydroxy-kappaO)-4'-(2-(1-(hydroxy-kappaO)-6-(phenylamino)-3-sulfo-2-naphthalenyl)diazenyl-kappaN1)(1,1'-biphenyl)-4-yl)diazenyl-kappaN1)-3-(hydroxy-kappaO)-2,7-naphthalenedisulfonato(7-)))di-, sodium (1:3)

Registry Numbers

CAS Registry Number

  • 68140-37-4

Other Registry Number

  • 74063-40-4

System Generated Number

  • 0068140374

Molecular Formulas

Molecular Formula

  • C38-H20-Cu2-N5-O13-S3.3Na

Molecular Formula Fragments

  • C38-H20-Cu2-N5-O13-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H27N5O13S3.2Cu.3Na/c44-31-13-7-20(16-30(31)41-42-35-27-11-9-26(57(48,49)50)15-23(27)19-34(38(35)47)59(54,55)56)21-6-12-29(32(45)17-21)40-43-36-33(58(51,52)53)18-22-14-25(8-10-28(22)37(36)46)39-24-4-2-1-3-5-24;;;;;/h1-19,39,44-47H,(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;;/q;2*+2;3*+1/p-7/b42-41-,43-40+;;;;;

InChIKey

PGLVXPZSWHWUIY-YJJIRTMLSA-G

Smiles

c1(S(=O)(=O)[O-])c(\N=N\c2c(cc(c3cc(\N=N/c4c(c(S(=O)(=O)[O-])cc5c4ccc(S(=O)(=O)[O-])c5)[O-])c(cc3)[O-])cc2)[O-])c([O-])c2c(c1)cc(Nc1ccccc1)cc2.[Cu+2].[Cu+2].[Na+].[Na+].[Na+]