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Substance Name: C.I. 18744
RN: 6054-86-0
UNII: 7S5S9Z912G
InChIKey: YAJDUQNWUWXIBO-ZAGWXBKKSA-M

Molecular Formula

  • C16-H13-N5-O7-S.Na

Molecular Weight

  • 441.355
 
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Names and Synonyms

Results Name

  • C.I. 18744

Name of Substance

  • Mordant Orange 29

Synonyms

  • C.I. Mordant Orange 29
  • EINECS 227-973-6
  • UNII-7S5S9Z912G

Systematic Names

  • Benzenesulfonic acid, 3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxy-5-nitro-, monosodium salt
  • Benzenesulfonic acid, 3-(2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-2-hydroxy-5-nitro-, sodium salt (1:1)
  • Sodium 3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxy-5-nitrobenzenesulphonate

Registry Numbers

CAS Registry Number

  • 6054-86-0

FDA UNII

  • 7S5S9Z912G

Other Registry Number

  • 1265344-14-6

System Generated Number

  • 0006054860

Molecular Formulas

Molecular Formula

  • C16-H13-N5-O7-S.Na

Molecular Formula Fragments

  • C16-H13-N5-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H13N5O7S.Na/c1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(21(24)25)8-13(15(12)22)29(26,27)28;/h2-8,14,22H,1H3,(H,26,27,28);/q;+1/p-1/b18-17+;

InChIKey

YAJDUQNWUWXIBO-ZAGWXBKKSA-M

Smiles

N1=C(C)[C@@H](\N=N\c2c(O)c(S(=O)(=O)[O-])cc([N+](=O)[O-])c2)C(=O)N1c1ccccc1.[Na+]