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Substance Name: Isoquinolinium, 1,2,3,4-tetrahydro-2-(2-ethoxy-2-oxoethyl)-2-methyl-, iodide
RN: 200064-93-3
InChIKey: LUWVIMUPKUFTCG-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-N-O2.I

Molecular Weight

  • 361.217
 
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Names and Synonyms

Synonyms

  • 1,2,3,4-Tetrahydro-2-(2-ethoxy-2-oxoethyl)-2-methylisoquinolinium iodide
  • Ethyl (1,2,3,4-tetrahydro-2-isoquinolyl)acetate methiodide

Systematic Name

  • Isoquinolinium, 1,2,3,4-tetrahydro-2-(2-ethoxy-2-oxoethyl)-2-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 200064-93-3

System Generated Number

  • 0200064933

Molecular Formulas

Molecular Formula

  • C14-H20-N-O2.I

Molecular Formula Fragments

  • C14-H20-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C14H20NO2.HI/c1-3-17-14(16)11-15(2)9-8-12-6-4-5-7-13(12)10-15;/h4-7H,3,8-11H2,1-2H3;1H/q+1;/p-1

InChIKey

LUWVIMUPKUFTCG-UHFFFAOYSA-M

Smiles

CCOC(=O)C[N+]1(CCc2ccccc2C1)C.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 129mg/kg (129mg/kg)   Chemistry of Heterocyclic Compounds Vol. 33, Pg. 234, 1997.