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Substance Name: 1H-Imidazole, 1-(2-(2-(4-chlorophenoxy)ethoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate
RN: 71821-41-5
InChIKey: MGTUQFCKCOPXBY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H17-Cl3-N2-O2.H-N-O3

Molecular Weight

  • 474.7262
 
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Names and Synonyms

Synonyms

  • 1-(2-(2-(4-Chlorophenoxy)ethoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate
  • 1-(beta-(p-Chlorphenoxyaethoxy-2,4-dichlorphenaethyl))-imidazol-nitrat
  • 1-(beta-(p-Chlorphenoxyaethoxy-2,4-dichlorphenaethyl))-imidazol-nitrat [German]

Systematic Name

  • 1H-Imidazole, 1-(2-(2-(4-chlorophenoxy)ethoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate

Registry Numbers

CAS Registry Number

  • 71821-41-5

System Generated Number

  • 0071821415

Molecular Formulas

Molecular Formula

  • C19-H17-Cl3-N2-O2.H-N-O3

Molecular Formula Fragments

  • C19-H17-Cl3-N2-O2
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C19H17Cl3N2O2.HNO3/c20-14-1-4-16(5-2-14)25-9-10-26-19(12-24-8-7-23-13-24)17-6-3-15(21)11-18(17)22;2-1(3)4/h1-8,11,13,19H,9-10,12H2;(H,2,3,4)

InChIKey

MGTUQFCKCOPXBY-UHFFFAOYSA-N

Smiles

c1cc(ccc1OCCOC(Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl.[N+](=O)(O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3500mg/kg (3500mg/kg)   Annals of the New York Academy of Sciences. Vol. 544, Pg. 63, 1988.