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Substance Name: 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate
RN: 79478-40-3
InChIKey: PFOOSJNPUJKCTM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H14-Cl2-N2-O.H-N-O3

Molecular Weight

  • 408.2395
 
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Names and Synonyms

Synonyms

  • 1-(1,2-Epoxy-3-(2,4-dichlorophenyl)-2-phenylpropyl)imidazole nitrate
  • 1-(3-((2,4-Dichlorophenyl)methyl)-3-phenyloxiranyl)-1H-imidazole mononitrate

Systematic Name

  • 1H-Imidazole, 1-(3-((2,4-dichlorophenyl)methyl)-3-phenyloxiranyl)-, mononitrate

Registry Numbers

CAS Registry Number

  • 79478-40-3

System Generated Number

  • 0079478403

Molecular Formulas

Molecular Formula

  • C18-H14-Cl2-N2-O.H-N-O3

Molecular Formula Fragments

  • C18-H14-Cl2-N2-O
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C18H14Cl2N2O.HNO3/c19-15-7-6-13(16(20)10-15)11-18(14-4-2-1-3-5-14)17(23-18)22-9-8-21-12-22;2-1(3)4/h1-10,12,17H,11H2;(H,2,3,4)

InChIKey

PFOOSJNPUJKCTM-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C2(C(O2)n3ccnc3)Cc4ccc(cc4Cl)Cl.[N+](=O)(O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0030371,