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Substance Name: 2-((4-(Ethyl(2-hydroxyisopropyl)amino)phenyl)azo)-6-methoxy-3-methylbenzothiazolium acetate
RN: 82281-90-1
InChIKey: LLFSOZDIZCSKAZ-UHFFFAOYSA-N

Molecular Formula

  • C20-H25-N4-O2-S.C2-H3-O2

Molecular Weight

  • 444.5532
 
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Names and Synonyms

Synonym

  • EINECS 279-925-9

Systematic Name

  • 2-((4-(Ethyl(2-hydroxyisopropyl)amino)phenyl)azo)-6-methoxy-3-methylbenzothiazolium acetate

Registry Numbers

CAS Registry Number

  • 82281-90-1

System Generated Number

  • 0082281901

Molecular Formulas

Molecular Formula

  • C20-H25-N4-O2-S.C2-H3-O2

Molecular Formula Fragments

  • C2-H3-O2
  • C20-H25-N4-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H24N4O2S.C2H4O2/c1-6-13-7-9-15(16(11-13)21-20(2,3)25)22-23-19-24(4)17-10-8-14(26-5)12-18(17)27-19;1-2(3)4/h7-12,25H,6H2,1-5H3;1H3,(H,3,4)

InChIKey

LLFSOZDIZCSKAZ-UHFFFAOYSA-N

Smiles

CCc1ccc(c(c1)NC(C)(C)O)/N=N/c2[n+](c3ccc(cc3s2)OC)C.CC(=O)[O-]