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Substance Name: Troxypyrrolidinium
RN: 24468-02-8
UNII: 3TGW42ZEPG
InChIKey: FYDIOQNEQHPRNW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H28-N-O5.C7-H7-O3-S

Molecular Weight

  • 338.4212
 
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Names and Synonyms

Results Name

  • Troxypyrrolidinium

Name of Substance

  • Troxypyrrolium

Synonyms

  • N-Ethyl-N-2-(3,4,5-trimethoxybenzoyloxy)ethyl pyrrolidinium tosylate
  • Troxypyrrolidinium
  • UNII-3TGW42ZEPG

Systematic Names

  • Pyrrolidinium, 1-ethyl-1-(2-((3,4,5-trimethoxybenzoyl)oxy)ethyl)- (9CI)
  • Pyrrolidinium, N-ethyl-N-(2-(3,4,5-trimethoxybenzoyloxy)ethyl)-, tosylate

Registry Numbers

CAS Registry Number

  • 24468-02-8

FDA UNII

  • 3TGW42ZEPG

System Generated Number

  • 0024468028

Molecular Formulas

Molecular Formula

  • C18-H28-N-O5.C7-H7-O3-S

Molecular Formula Fragments

  • C18-H28-N-O5
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C18H28NO5/c1-5-19(8-6-7-9-19)10-11-24-18(20)14-12-15(21-2)17(23-4)16(13-14)22-3/h12-13H,5-11H2,1-4H3/q+1

InChIKey

FYDIOQNEQHPRNW-UHFFFAOYSA-N

Smiles

CC[N+]1(CCCC1)CCOC(=O)c2cc(c(c(c2)OC)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 31mg/kg (31mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 25, Pg. 228, 1966.