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Substance Name: 1H-Imidazole, 1-(2-(2,4-dichlorophenyl)-2-((4-methoxyphenoxy)methoxy)ethyl)-, mononitrate
RN: 71821-05-1
InChIKey: KXFKVZMEHNZSJI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H18-Cl2-N2-O3.H-N-O3

Molecular Weight

  • 456.2801
 
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Names and Synonyms

Synonym

  • 1-(2-(2,4-Dichlorophenyl)-2-((4-methoxyphenoxy)methoxy)ethyl)-1H-imidazole nitrate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 71821-05-1

System Generated Number

  • 0071821051

Molecular Formulas

Molecular Formula

  • C19-H18-Cl2-N2-O3.H-N-O3

Molecular Formula Fragments

  • C19-H18-Cl2-N2-O3
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C19H18Cl2N2O3.HNO3/c1-24-15-3-5-16(6-4-15)25-13-26-19(11-23-9-8-22-12-23)17-7-2-14(20)10-18(17)21;2-1(3)4/h2-10,12,19H,11,13H2,1H3;(H,2,3,4)

InChIKey

KXFKVZMEHNZSJI-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)OCOC(Cn2ccnc2)c3ccc(cc3Cl)Cl.[N+](=O)(O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2600mg/kg (2600mg/kg)   Annals of the New York Academy of Sciences. Vol. 544, Pg. 63, 1988.