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Substance Name: Ammonium, (((4-carboxy-3-hydroxyphenyl)carbamoyl)methyl)trimethyl-, iodide, ethyl ester
RN: 14034-38-9
InChIKey: ACZPOLOSYSMCTP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N2-O4.I

Molecular Weight

  • 408.23
 
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Names and Synonyms

Synonym

  • (((4-Carboxy-3-hydroxyphenyl)carbamoyl)methyl)trimethylammonium iodide ethyl ester

Systematic Name

  • Ammonium, (((4-carboxy-3-hydroxyphenyl)carbamoyl)methyl)trimethyl-, iodide, ethyl ester

Registry Numbers

CAS Registry Number

  • 14034-38-9

System Generated Number

  • 0014034389

Molecular Formulas

Molecular Formula

  • C14-H21-N2-O4.I

Molecular Formula Fragments

  • C14-H21-N2-O4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C14H20N2O4.HI/c1-5-20-14(19)11-7-6-10(8-12(11)17)15-13(18)9-16(2,3)4;/h6-8H,5,9H2,1-4H3,(H-,15,17,18,19);1H

InChIKey

ACZPOLOSYSMCTP-UHFFFAOYSA-N

Smiles

[IH-].[N+](C)(C)(C)CC(Nc1cc(c(cc1)C(=O)OCC)O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 10, Pg. 235, 1967.