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Substance Name: Ammonium, dimethylethyl(2-(7-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)ethyl)-, bromide, dimethylcarbamate (ester)
RN: 97051-00-8
InChIKey: OONBSEYJOSGCIG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H26-N3-O4.Br

Molecular Weight

  • 416.3134
 
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Names and Synonyms

  • Ammonium, dimethylethyl(2-(7-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)ethyl)-, bromide, dimethylcarbamate (ester)

Registry Numbers

CAS Registry Number

  • 97051-00-8

System Generated Number

  • 0097051008

Molecular Formulas

Molecular Formula

  • C17-H26-N3-O4.Br

Molecular Formula Fragments

  • Br
  • C17-H26-N3-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25N3O4.BrH/c1-17(2,3)18-8-9-20-13-7-6-12(24-16(22)19(4)5)10-14(13)23-11-15(20)21;/h6-7,10,18H,8-9,11H2,1-5H3;1H

InChIKey

OONBSEYJOSGCIG-UHFFFAOYSA-N

Smiles

CC(C)(C)[NH2+]CCN1c2ccc(cc2OCC1=O)OC(=O)N(C)C.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 20, Pg. 37, 1985.