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Substance Name: Piperazinium, 1-ethyl-4-(2-(p-hydroxyphenoxy)acetyl)-1-methyl-, iodide, dimethylcarbamate
RN: 102517-18-0
InChIKey: VWUBGNQRXYVNKZ-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H28-N3-O4.I

Molecular Weight

  • 477.3362
 
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Names and Synonyms

Synonym

  • 1-Ethyl-4-(2-(p-hydroxyphenoxy)acetyl)-1-methylpiperazinium iodide dimethylcarbamate

Systematic Name

  • Piperazinium, 1-ethyl-4-(2-(p-hydroxyphenoxy)acetyl)-1-methyl-, iodide, dimethylcarbamate

Registry Numbers

CAS Registry Number

  • 102517-18-0

System Generated Number

  • 0102517180

Molecular Formulas

Molecular Formula

  • C18-H28-N3-O4.I

Molecular Formula Fragments

  • C18-H28-N3-O4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C18H28N3O4.HI/c1-5-21(4)12-10-20(11-13-21)17(22)14-24-15-6-8-16(9-7-15)25-18(23)19(2)3;/h6-9H,5,10-14H2,1-4H3;1H/q+1;/p-1

InChIKey

VWUBGNQRXYVNKZ-UHFFFAOYSA-M

Smiles

CC[N+]1(CCN(CC1)C(=O)COc2ccc(cc2)OC(=O)N(C)C)C.[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 20, Pg. 37, 1985.