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Substance Name: Methanone, (4-aminophenyl)(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-, hydrochloride
RN: 123769-55-1
InChIKey: UEWNEXOUTKUPLM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H15-N-O3.Cl-H

Molecular Weight

  • 305.7594
 
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Names and Synonyms

Synonyms

  • (4-Aminophenyl)(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone hydrochloride
  • 7-(p-Aminobenzoyl)-1,5-benzodioxepane hydrochloride

Systematic Name

  • Methanone, (4-aminophenyl)(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 123769-55-1

System Generated Number

  • 0123769551

Molecular Formulas

Molecular Formula

  • C16-H15-N-O3.Cl-H

Molecular Formula Fragments

  • C16-H15-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H15NO3.ClH/c17-13-5-2-11(3-6-13)16(18)12-4-7-14-15(10-12)20-9-1-8-19-14;/h2-7,10H,1,8-9,17H2;1H

InChIKey

UEWNEXOUTKUPLM-UHFFFAOYSA-N

Smiles

c1cc(ccc1C(=O)c2ccc3c(c2)OCCCO3)N.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1500mg/kg (1500mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 322, 1989.