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Substance Name: Cobaltate(8-), bis(4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-7-((3-phosphonophenyl)amino)-2-naphthalenesulfonato(5-))-, ammonium hydrogen (1:4:4)
RN: 70833-34-0
InChIKey: GXRMKQNUPONVCD-BECYCFEHSA-L

Molecular Formula

  • C44-H24-Co-N8-O20-P2-S2.4H4-N.4H

Molecular Weight

  • 1245.9086
 
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Names and Synonyms

Synonym

  • 4-Hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)-7-((3-phosphonophenyl)amino)-2-naphthalenesulfonic acid, tetraammonium salt, cobalt complex (2:1)

Systematic Names

  • Cobaltate(8-), bis(4-(hydroxy-kappaO)-3-((2-(hydroxy-kappaO)-5-nitrophenyl)azo-kappaN1)-7-((3-phosphonophenyl)amino)-2-naphthalenesulfonato(5-))-, tetraammonium tetrahydrogen
  • Cobaltate(8-), bis(4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-7-((3-phosphonophenyl)amino)-2-naphthalenesulfonato(5-))-, ammonium hydrogen (1:4:4)

Registry Numbers

CAS Registry Number

  • 70833-34-0

System Generated Number

  • 0070833340

Molecular Formulas

Molecular Formula

  • C44-H24-Co-N8-O20-P2-S2.4H4-N.4H

Molecular Formula Fragments

  • C44-H24-Co-N8-O20-P2-S2
  • COMPONENT
  • H
  • H4-N

Structure Descriptors

InChI

1S/2C22H17N4O10PS.Co.4H3N/c2*27-19-7-5-15(26(29)30)11-18(19)24-25-21-20(38(34,35)36)9-12-8-14(4-6-17(12)22(21)28)23-13-2-1-3-16(10-13)37(31,32)33;;;;;/h2*1-11,23,27-28H,(H2,31,32,33)(H,34,35,36);;4*1H3/q;;+2;;;;/p-2/b2*25-24+;;;;;

InChIKey

GXRMKQNUPONVCD-BECYCFEHSA-L

Smiles

[H+].[H+].[H+].[H+].c1cc2cc(c1)Nc3cc4c(c5c\6c(c4)S(=O)(=O)O[Co-8]78914(O5)(OS(=O)(=O)c5c(c(c%10c(c5)cc(cc%10)Nc5cc(ccc5)P(=O)(O7)O8)O9)/N=N/c5c(ccc(c5)[N+](=O)[O-])O1)(OP2(=O)O4)Oc1c(cc(cc1)[N+](=O)[O-])/N=N6)cc3.[NH4+].[NH4+].[NH4+].[NH4+]