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Substance Name: Ammonium, (beta-hydroxyphenethyl)trimethyl-, iodide, benzoate (ester)
ID: BR15780100
InChIKey: JHRCBERGOHNJLQ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H22-N-O2.I

Molecular Weight

  • 411.2768
 
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Names and Synonyms

Synonym

  • (beta-Hydroxyphenethyl)trimethylammonium iodide benzoate (ester)

Systematic Name

  • Ammonium, (beta-hydroxyphenethyl)trimethyl-, iodide, benzoate (ester)

Registry Numbers

ID Number

  • NIOSH/BR1578010

System Generated Number

  • BR15780100

Molecular Formulas

Molecular Formula

  • C18-H22-N-O2.I

Molecular Formula Fragments

  • C18-H22-N-O2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C18H22NO2.HI/c1-19(2,3)14-17(15-10-6-4-7-11-15)21-18(20)16-12-8-5-9-13-16;/h4-13,17H,14H2,1-3H3;1H/q+1;/p-1

InChIKey

JHRCBERGOHNJLQ-UHFFFAOYSA-M

Smiles

[I-].C[N+](C)(C)CC(OC(=O)c1ccccc1)c2ccccc2