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Substance Name: 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-bromo-, O-(2-(diethylamino)ethyl)oxime, monohydrochloride
RN: 55580-10-4
InChIKey: JZJDZVLQORGTLL-MWIGPOFTSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-Br-N2-O2.Cl-H

Molecular Weight

  • 391.7346
 
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Names and Synonyms

Synonym

  • 7-Bromo-3,4-dihydro-1-benzoxepin-O-(diethylaminoethyl)-5-one oxime hydrochloride

Systematic Name

  • 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-bromo-, O-(2-(diethylamino)ethyl)oxime, monohydrochloride

Registry Numbers

CAS Registry Number

  • 55580-10-4

System Generated Number

  • 0055580104

Molecular Formulas

Molecular Formula

  • C16-H23-Br-N2-O2.Cl-H

Molecular Formula Fragments

  • C16-H23-Br-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H23BrN2O2.ClH/c1-3-19(4-2)9-11-21-18-15-6-5-10-20-16-8-7-13(17)12-14(15)16;/h7-8,12H,3-6,9-11H2,1-2H3;1H/b18-15-;

InChIKey

JZJDZVLQORGTLL-MWIGPOFTSA-N

Smiles

CCN(CC)CCO/N=C\1/CCCOc2c1cc(cc2)Br.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 40mg/kg (40mg/kg)   United States Patent Document. Vol. #4179516,
mouse LD50 oral 250mg/kg (250mg/kg)   United States Patent Document. Vol. #4179516,