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Substance Name: Disodium 4-((4-(2,3-dichloroquinoxaline-6-carboxamido)-2-sulphonatophenyl)azo)-3-methyl-5-oxo-2-pyrazolin-1-acetate
RN: 32686-78-5
InChIKey: ODJZJZJYGPBYQD-RSCMZZNTSA-L

Molecular Formula

  • C21-H15-Cl2-N7-O7-S.2Na

Molecular Weight

  • 626.3435
 
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Names and Synonyms

Synonym

  • EINECS 251-154-2

Systematic Name

  • Disodium 4-((4-(2,3-dichloroquinoxaline-6-carboxamido)-2-sulphonatophenyl)azo)-3-methyl-5-oxo-2-pyrazolin-1-acetate

Registry Numbers

CAS Registry Number

  • 32686-78-5

System Generated Number

  • 0032686785

Molecular Formulas

Molecular Formula

  • C21-H15-Cl2-N7-O7-S.2Na

Molecular Formula Fragments

  • C21-H15-Cl2-N7-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H17Cl2N7O7S.2Na/c1-11-18(21(34)28(26-11)9-17(32)33)25-27-30-13-7-6-12(24-10-31)8-15(13)29(19(22)20(30)23)14-4-2-3-5-16(14)38(35,36)37;;/h2-8,10,18H,9H2,1H3,(H,24,31)(H,32,33)(H,35,36,37);;/q;2*+1/p-2/b27-25+;;

InChIKey

ODJZJZJYGPBYQD-RSCMZZNTSA-L

Smiles

c1(n(c2c(n(c1Cl)c1c(S(=O)(=O)[O-])cccc1)cc(NC=O)cc2)/N=N/C1C(=O)N(N=C1C)CC(=O)[O-])Cl.[Na+].[Na+]