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Substance Name: Disodium (5-((1-(anilinocarbonyl)-2-oxopropyl)azo)-4-hydroxy-3-nitrobenzenesulphonato(3-))(2-((2-hydroxy-5-nitrophenyl)azo)-3-oxo-N-phenylbutyramidato(2-))cobaltate(2-)
RN: 76762-27-1
InChIKey: PPNYGQNWFGPXDT-CNRKMFMQSA-I

Molecular Formula

  • C32-H23-Co-N8-O13-S.2Na

Molecular Weight

  • 864.5557
 
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Names and Synonyms

Synonym

  • EINECS 278-545-0

Systematic Name

  • Disodium (5-((1-(anilinocarbonyl)-2-oxopropyl)azo)-4-hydroxy-3-nitrobenzenesulphonato(3-))(2-((2-hydroxy-5-nitrophenyl)azo)-3-oxo-N-phenylbutyramidato(2-))cobaltate(2-)

Registry Numbers

CAS Registry Number

  • 76762-27-1

System Generated Number

  • 0076762271

Molecular Formulas

Molecular Formula

  • C32-H23-Co-N8-O13-S.2Na

Molecular Formula Fragments

  • C32-H23-Co-N8-O13-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H14N4O8S.C16H14N4O5.Co.2Na/c1-9(21)14(16(23)17-10-5-3-2-4-6-10)19-18-12-7-11(29(26,27)28)8-13(15(12)22)20(24)25;1-10(21)15(16(23)17-11-5-3-2-4-6-11)19-18-13-9-12(20(24)25)7-8-14(13)22;;;/h2-8,21-22H,1H3,(H,17,23)(H,26,27,28);2-9,21-22H,1H3,(H,17,23);;;/q;;+3;2*+1/p-5/b14-9-,19-18+;15-10-,19-18+;;;

InChIKey

PPNYGQNWFGPXDT-CNRKMFMQSA-I

Smiles

C/C/1=C(/N=N/c2cc(ccc2O[Co-2]345(O1)Oc6c(cc(cc6[N+](=O)[O-])S(=O3)(=O)O4)/N=N/C(=C(\O5)/C)/C(=O)Nc7ccccc7)[N+](=O)[O-])\C(=O)Nc8ccccc8.[Na+].[Na+]