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Substance Name: Trisodium bis(5-(((4-hydroxy-3-((2-oxo-1-((phenylamino)carbonyl)propyl)azo)phenyl)sulphonyl)amino)naphthalene-2-sulphonato(3-))cobaltate(3-)
RN: 85958-78-7
InChIKey: WICPEKOMBAAAOC-MGKCUEKMSA-J

Molecular Formula

  • C52-H38-Co-N8-O16-S4.3Na

Molecular Weight

  • 1287.0792
 
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Names and Synonyms

Synonym

  • EINECS 288-965-6

Systematic Name

  • Trisodium bis(5-(((4-hydroxy-3-((2-oxo-1-((phenylamino)carbonyl)propyl)azo)phenyl)sulphonyl)amino)naphthalene-2-sulphonato(3-))cobaltate(3-)

Registry Numbers

CAS Registry Number

  • 85958-78-7

System Generated Number

  • 0085958787

Molecular Formulas

Molecular Formula

  • C52-H38-Co-N8-O16-S4.3Na

Molecular Formula Fragments

  • C52-H38-Co-N8-O16-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/2C26H21N4O8S2.Co.3Na/c2*1-16(31)25(26(33)27-18-7-3-2-4-8-18)29-28-23-15-19(11-13-24(23)32)39(34,35)30-22-9-5-6-17-14-20(40(36,37)38)10-12-21(17)22;;;;/h2*2-15,30,32H,1H3,(H,27,33)(H,36,37,38);;;;/q;;4*+1/p-4/b2*29-28+;;;;

InChIKey

WICPEKOMBAAAOC-MGKCUEKMSA-J

Smiles

[Na+].[Na+].[Na+].CC(=O)C1(N=Nc2cc3ccc2O[Co-3]145(Oc6ccc(cc6N=NC4(C(=O)C)C(=O)Nc7ccccc7)S(=O)(=O)Nc8cccc9cc(ccc89)S(=O)(=O)O5)OS(=O)(=O)c%10ccc%11c(NS3(=O)=O)cccc%11c%10)C(=O)Nc%12ccccc%12