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Substance Name: 1H-Imidazole, 1-(2-butoxy-2-(2,4-dichlorophenyl)ethenyl)-, mononitrate
RN: 74287-42-6
InChIKey: MFOUOQOBNZLFAS-AZJSCORLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-Cl2-N2-O.H-N-O3

Molecular Weight

  • 374.2223
 
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Names and Synonyms

Synonym

  • 1-(2-Butoxy-2-(2,4-dichlorophenyl)ethenyl)-1H-imidazole nitrate

Systematic Name

  • 1H-Imidazole, 1-(2-butoxy-2-(2,4-dichlorophenyl)ethenyl)-, mononitrate

Registry Numbers

CAS Registry Number

  • 74287-42-6

System Generated Number

  • 0074287426

Molecular Formulas

Molecular Formula

  • C15-H16-Cl2-N2-O.H-N-O3

Molecular Formula Fragments

  • C15-H16-Cl2-N2-O
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C15H16Cl2N2O.HNO3/c1-2-3-8-20-15(10-19-7-6-18-11-19)13-5-4-12(16)9-14(13)17;2-1(3)4/h4-7,9-11H,2-3,8H2,1H3;(H,2,3,4)/b15-10-;

InChIKey

MFOUOQOBNZLFAS-AZJSCORLSA-N

Smiles

CCCCO/C(=C\n1ccnc1)/c2ccc(cc2Cl)Cl.[N+](=O)(O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 165mg/kg (165mg/kg)   Annals of the New York Academy of Sciences. Vol. 544, Pg. 63, 1988.