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Substance Name: 3-Oxa-9-azoniatricyclo(3.3.1.0(sup 2,4))nonane, 9-ethyl-9-methyl-7-((1-oxo-2-propylpentyl)oxy)-, bromide, stereoisomer
RN: 96392-88-0
InChIKey: XQPFLZAWXSNUAB-ZDKJDNHKSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H32-N-O3.Br

Molecular Weight

  • 390.3588
 
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Names and Synonyms

  • 3-Oxa-9-azoniatricyclo(3.3.1.0(sup 2,4))nonane, 9-ethyl-9-methyl-7-((1-oxo-2-propylpentyl)oxy)-, bromide, stereoisomer

Registry Numbers

CAS Registry Number

  • 96392-88-0

System Generated Number

  • 0096392880

Molecular Formulas

Molecular Formula

  • C18-H32-N-O3.Br

Molecular Formula Fragments

  • Br
  • C18-H32-N-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C18H32NO3.BrH/c1-5-8-12(9-6-2)18(20)21-13-10-14-16-17(22-16)15(11-13)19(14,4)7-3;/h12-17H,5-11H2,1-4H3;1H/q+1;/p-1/t13?,14-,15-,16-,17+,19?;/m0./s1

InChIKey

XQPFLZAWXSNUAB-ZDKJDNHKSA-M

Smiles

CCCC(CCC)C(=O)OC1C[C@H]2[C@@H]3[C@@H](O3)[C@H](C1)[N+]2(C)CC.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 72mg/kg (72mg/kg)   United States Patent Document. Vol. #4558054,