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Substance Name: Cobaltate(2-), (2,4-dihydro-4-((2-hydroxy-5-nitrophenyl)azo)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-))(2-(((4-hydroxy-3-((2-(phenylamino)-1-naphthalenyl)azo)phenyl)sulfonyl)amino)benzoato(3-))-, disodium
RN: 82556-13-6
InChIKey: MZJXMSSSZMCOFR-QDRVBAQASA-J

Molecular Formula

  • C45-H30-Co-N9-O9-S.2Na

Molecular Weight

  • 977.765
 
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Names and Synonyms

Synonym

  • EINECS 279-994-5

Systematic Name

  • Cobaltate(2-), (2,4-dihydro-4-((2-hydroxy-5-nitrophenyl)azo)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-))(2-(((4-hydroxy-3-((2-(phenylamino)-1-naphthalenyl)azo)phenyl)sulfonyl)amino)benzoato(3-))-, disodium

Registry Numbers

CAS Registry Number

  • 82556-13-6

System Generated Number

  • 0082556136

Molecular Formulas

Molecular Formula

  • C45-H30-Co-N9-O9-S.2Na

Molecular Formula Fragments

  • C45-H30-Co-N9-O9-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H22N4O5S.C16H12N5O4.Co.2Na/c34-27-17-15-21(39(37,38)33-24-13-7-6-12-23(24)29(35)36)18-26(27)31-32-28-22-11-5-4-8-19(22)14-16-25(28)30-20-9-2-1-3-10-20;1-10-15(16(23)20(19-10)11-5-3-2-4-6-11)18-17-13-9-12(21(24)25)7-8-14(13)22;;;/h1-18,33H,(H3,30,31,32,34,35,36);2-9,22H,1H3;;;/q;;+2;2*+1/p-4/b;18-17+;;;

InChIKey

MZJXMSSSZMCOFR-QDRVBAQASA-J

Smiles

CC1=NN(C(=O)C12N=Nc3cc(ccc3O[Co-2]245N(c6ccc7ccccc7c6/N=N/c8cc(ccc8O4)S(=O)(=O)Nc9ccccc9C(=O)O5)c1ccccc1)[N+](=O)[O-])c1ccccc1.[Na+].[Na+]