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Substance Name: 1H-Imidazole, 1-(2-(2-butoxyethoxy)-2-(2,4-dichlorophenyl)ethenyl)-, mononitrate
RN: 83621-08-3
InChIKey: HDYMYODDCXLSHF-HBPAQXCTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H20-Cl2-N2-O2.H-N-O3

Molecular Weight

  • 418.2749
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 83621-08-3

System Generated Number

  • 0083621083

Molecular Formulas

Molecular Formula

  • C17-H20-Cl2-N2-O2.H-N-O3

Molecular Formula Fragments

  • C17-H20-Cl2-N2-O2
  • COMPONENT
  • H-N-O3

Structure Descriptors

InChI

1S/C17H20Cl2N2O2.HNO3/c1-2-3-8-22-9-10-23-17(12-21-7-6-20-13-21)15-5-4-14(18)11-16(15)19;2-1(3)4/h4-7,11-13H,2-3,8-10H2,1H3;(H,2,3,4)/b17-12-;

InChIKey

HDYMYODDCXLSHF-HBPAQXCTSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 470mg/kg (470mg/kg)   Annals of the New York Academy of Sciences. Vol. 544, Pg. 63, 1988.