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Substance Name: 1H-Imidazole, 1-(2-((2,4-dichlorophenoxy)methoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate
RN: 72051-43-5
InChIKey: QQUFASXCGAGXSG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H14-Cl4-N2-O2.H-N-O3

Molecular Weight

  • 495.1445
 
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Names and Synonyms

Synonym

  • 1-(2-((2,4-Dichlorophenoxy)methoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole nitrate

Systematic Name

  • 1H-Imidazole, 1-(2-((2,4-dichlorophenoxy)methoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrate

Registry Numbers

CAS Registry Number

  • 72051-43-5

System Generated Number

  • 0072051435

Molecular Formulas

Molecular Formula

  • C18-H14-Cl4-N2-O2.H-N-O3

Molecular Formula Fragments

  • C18-H14-Cl4-N2-O2
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C18H14Cl4N2O2.HNO3/c19-12-1-3-14(15(21)7-12)18(9-24-6-5-23-10-24)26-11-25-17-4-2-13(20)8-16(17)22;2-1(3)4/h1-8,10,18H,9,11H2;(H,2,3,4)

InChIKey

QQUFASXCGAGXSG-UHFFFAOYSA-N

Smiles

c1cc(c(cc1Cl)Cl)C(Cn2ccnc2)OCOc3ccc(cc3Cl)Cl.[N+](=O)(O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 9gm/kg (9000mg/kg)   Annals of the New York Academy of Sciences. Vol. 544, Pg. 63, 1988.