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Substance Name: 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-chloro-, O-(3-(dimethylamino)propyl)oxime, monohydrochloride
RN: 55579-98-1
InChIKey: DLIZDJYXVJTGCC-SBBUSYCLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-Cl-N2-O2.Cl-H

Molecular Weight

  • 333.2568
 
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Names and Synonyms

Synonym

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

Systematic Name

  • 1-Benzoxepin-5(2H)-one, 3,4-dihydro-7-chloro-, O-(3-(dimethylamino)propyl)oxime, monohydrochloride

Registry Numbers

CAS Registry Number

  • 55579-98-1

System Generated Number

  • 0055579981

Molecular Formulas

Molecular Formula

  • C15-H21-Cl-N2-O2.Cl-H

Molecular Formula Fragments

  • C15-H21-Cl-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H21ClN2O2.ClH/c1-18(2)8-4-10-20-17-14-5-3-9-19-15-7-6-12(16)11-13(14)15;/h6-7,11H,3-5,8-10H2,1-2H3;1H/b17-14-;

InChIKey

DLIZDJYXVJTGCC-SBBUSYCLSA-N

Smiles

CN(C)CCCO/N=C\1/CCCOc2c1cc(cc2)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 60mg/kg (60mg/kg)   United States Patent Document. Vol. #4179516,
mouse LD50 oral 500mg/kg (500mg/kg)   United States Patent Document. Vol. #4179516,