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Substance Name: Ethanaminium, 2-(2-(benzoyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, iodide
RN: 73231-84-2
InChIKey: WIQXQMZJICMNHA-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-N-O4.I

Molecular Weight

  • 407.2418
 
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Names and Synonyms

Synonym

  • 2-(2-(Benzoyloxy)-1-oxopropoxy)-N,N,N-trimethylethanaminium iodide

Systematic Name

  • Ethanaminium, 2-(2-(benzoyloxy)-1-oxopropoxy)-N,N,N-trimethyl-, iodide

Registry Numbers

CAS Registry Number

  • 73231-84-2

System Generated Number

  • 0073231842

Molecular Formulas

Molecular Formula

  • C15-H22-N-O4.I

Molecular Formula Fragments

  • C15-H22-N-O4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C15H22NO4.HI/c1-12(14(17)19-11-10-16(2,3)4)20-15(18)13-8-6-5-7-9-13;/h5-9,12H,10-11H2,1-4H3;1H/q+1;/p-1

InChIKey

WIQXQMZJICMNHA-UHFFFAOYSA-M

Smiles

CC(C(=O)OCC[N+](C)(C)C)OC(=O)c1ccccc1.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 400mg/kg (400mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 99, Pg. 1245, 1979.