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Substance Name: 3-((4-(Benzylmethylamino)phenyl)azo)-1,2-dimethyl-1H-1,2,4-triazolium methyl sulphate
RN: 85068-64-0
InChIKey: LIRMGYSKOMHODJ-UHFFFAOYSA-M

Molecular Formula

  • C18-H21-N6.C-H3-O4-S

Molecular Weight

  • 432.5026
 
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Names and Synonyms

Synonym

  • EINECS 285-322-1

Systematic Name

  • 3-((4-(Benzylmethylamino)phenyl)azo)-1,2-dimethyl-1H-1,2,4-triazolium methyl sulphate

Registry Numbers

CAS Registry Number

  • 85068-64-0

System Generated Number

  • 0085068640

Molecular Formulas

Molecular Formula

  • C18-H21-N6.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C18-H21-N6
  • COMPONENT

Structure Descriptors

InChI

1S/C18H21N6.CH4O4S/c1-22(13-15-7-5-4-6-8-15)17-11-9-16(10-12-17)20-21-18-19-14-23(2)24(18)3;1-5-6(2,3)4/h4-12,14H,13H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

LIRMGYSKOMHODJ-UHFFFAOYSA-M

Smiles

Cn1c(nc[n+]1C)/N=N/c2ccc(cc2)N(C)Cc3ccccc3.COS(=O)(=O)[O-]