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Substance Name: Morpholinium, 4-allyl-4-(3-hydroxy-3-phenyl-3-(2-thienyl)propyl)-, bromide
RN: 2238-77-9
InChIKey: OLEOFSVNCNEGPY-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H26-N-O2-S.Br

Molecular Weight

  • 424.4
 
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Names and Synonyms

Synonym

  • 4-Allyl-4-(3-hydroxy-3-phenyl-3-(2-thienyl)propyl)morpholinium bromide

Systematic Name

  • Morpholinium, 4-allyl-4-(3-hydroxy-3-phenyl-3-(2-thienyl)propyl)-, bromide

Registry Numbers

CAS Registry Number

  • 2238-77-9

System Generated Number

  • 0002238779

Molecular Formulas

Molecular Formula

  • C20-H26-N-O2-S.Br

Molecular Formula Fragments

  • Br
  • C20-H26-N-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H26NO2S.BrH/c1-2-11-21(13-15-23-16-14-21)12-10-20(22,19-9-6-17-24-19)18-7-4-3-5-8-18;/h2-9,17,22H,1,10-16H2;1H/q+1;/p-1

InChIKey

OLEOFSVNCNEGPY-UHFFFAOYSA-M

Smiles

C1C[N+](CCO1)(CC[C@@](c1cccs1)(c1ccccc1)O)CC=C.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32mg/kg (32mg/kg)   Medicina et Pharmacologia Experimentalis. Vol. 12, Pg. 326, 1965.