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Substance Name: Sodium (1-((5-(ethylsulphonyl)-2-hydroxyphenyl)azo)-2-naphtholato(2-))(methyl (8-((5-(ethylsulphonyl)-2-hydroxyphenyl)azo)-7-hydroxy-1-naphthyl)methylcarbamato(2-))cobaltate(1-)
RN: 85650-70-0
InChIKey: JWQVXYXMKWYNTN-HPPQUXGRSA-J

Molecular Formula

  • C39-H33-Co-N5-O10-S2.Na

Molecular Weight

  • 877.7697
 
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Names and Synonyms

Synonym

  • EINECS 288-080-5

Systematic Name

  • Sodium (1-((5-(ethylsulphonyl)-2-hydroxyphenyl)azo)-2-naphtholato(2-))(methyl (8-((5-(ethylsulphonyl)-2-hydroxyphenyl)azo)-7-hydroxy-1-naphthyl)methylcarbamato(2-))cobaltate(1-)

Registry Numbers

CAS Registry Number

  • 85650-70-0

System Generated Number

  • 0085650700

Molecular Formulas

Molecular Formula

  • C39-H33-Co-N5-O10-S2.Na

Molecular Formula Fragments

  • C39-H33-Co-N5-O10-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H21N3O6S.C18H16N2O4S.Co.Na/c1-3-31(28,29)15-8-10-17(25)16(11-15)23-24-20-18(26)9-7-13-5-4-6-14(19(13)20)12-30-21(27)22-2;1-2-25(23,24)13-8-10-16(21)15(11-13)19-20-18-14-6-4-3-5-12(14)7-9-17(18)22;;/h4-11,25-26H,3,12H2,1-2H3,(H,22,27);3-11,21-22H,2H2,1H3;;/q;;+3;+1/p-4/b24-23+;20-19+;;

InChIKey

JWQVXYXMKWYNTN-HPPQUXGRSA-J

Smiles

[Na+].CCS(=O)(=O)c1ccc2O[Co-]3(Oc4ccc(cc4N=Nc5c(O3)ccc6cccc(COC(=O)NC)c56)S(=O)(=O)CC)Oc7ccc8ccccc8c7N=Nc2c1