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Substance Name: 1H-Imidazole, 1-(3-(2-chlorophenyl)-3-(3-methoxyphenyl)oxiranyl)-, mononitrate
RN: 79478-67-4
InChIKey: OAYSASBKSBOYDZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H15-Cl-N2-O2.H-N-O3

Molecular Weight

  • 389.7934
 
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Names and Synonyms

Synonyms

  • 1-(1,2-Epoxy-2-(2-chlorophenyl)-2-(3-methoxyphenyl)ethyl)imidazole nitrate
  • 1-(3-(2-Chlorophenyl)-3-(3-methoxyphenyl)oxiranyl)-1H-imidazole mononitrate

Systematic Name

  • 1H-Imidazole, 1-(3-(2-chlorophenyl)-3-(3-methoxyphenyl)oxiranyl)-, mononitrate

Registry Numbers

CAS Registry Number

  • 79478-67-4

System Generated Number

  • 0079478674

Molecular Formulas

Molecular Formula

  • C18-H15-Cl-N2-O2.H-N-O3

Molecular Formula Fragments

  • C18-H15-Cl-N2-O2
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C18H15ClN2O2.HNO3/c1-22-14-6-4-5-13(11-14)18(15-7-2-3-8-16(15)19)17(23-18)21-10-9-20-12-21;2-1(3)4/h2-12,17H,1H3;(H,2,3,4)

InChIKey

OAYSASBKSBOYDZ-UHFFFAOYSA-N

Smiles

COc1cccc(c1)C2(C(O2)n3ccnc3)c4ccccc4Cl.[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,