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Substance Name: 1-Azoniabicyclo(2.2.2)octane, 3-hydroxy-1-(2-((4-methyl-2-oxo-2H-1benzopyran-7-yl)oxy)ethyl)-, bromide
RN: 155272-60-9
InChIKey: CTUSBCROFCVLLW-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-N-O4.Br

Molecular Weight

  • 410.3056
 
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Names and Synonyms

Synonym

  • Quinuclidinium, 3-hydroxy-1-(2-((4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)ethyl)-, bromide

Systematic Name

  • 1-Azoniabicyclo(2.2.2)octane, 3-hydroxy-1-(2-((4-methyl-2-oxo-2H-1benzopyran-7-yl)oxy)ethyl)-, bromide

Registry Numbers

CAS Registry Number

  • 155272-60-9

System Generated Number

  • 0155272609

Molecular Formulas

Molecular Formula

  • C19-H24-N-O4.Br

Molecular Formula Fragments

  • Br
  • C19-H24-N-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H24NO4.BrH/c1-13-10-19(22)24-18-11-15(2-3-16(13)18)23-9-8-20-6-4-14(5-7-20)17(21)12-20;/h2-3,10-11,14,17,21H,4-9,12H2,1H3;1H/q+1;/p-1

InChIKey

CTUSBCROFCVLLW-UHFFFAOYSA-M

Smiles

Cc1cc(=O)oc2c1ccc(c2)OCC[N+]34CCC(CC3)C(C4)O.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 290mg/kg (290mg/kg)   Pharmaceutical Chemistry Journal Vol. 27, Pg. 766, 1993.