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Substance Name: Ethanaminium, N,N-dimethyl-N-ethyl-2-(3-(1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)phenoxy)-, bromide
RN: 69859-82-1
InChIKey: YYXNVXSVUOKYQA-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N2-O3.Br

Molecular Weight

  • 435.3593
 
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Names and Synonyms

  • Ethanaminium, N,N-dimethyl-N-ethyl-2-(3-(1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)phenoxy)-, bromide

Registry Numbers

CAS Registry Number

  • 69859-82-1

System Generated Number

  • 0069859821

Molecular Formulas

Molecular Formula

  • C21-H27-N2-O3.Br

Molecular Formula Fragments

  • Br
  • C21-H27-N2-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27N2O3.BrH/c1-4-23(2,3)10-11-26-17-7-5-6-16(13-17)22-20(24)18-14-8-9-15(12-14)19(18)21(22)25;/h5-9,13-15,18-19H,4,10-12H2,1-3H3;1H/q+1;/p-1

InChIKey

YYXNVXSVUOKYQA-UHFFFAOYSA-M

Smiles

CC[N+](C)(C)CCOc1cccc(c1)N2C(=O)C3C4CC(C3C2=O)C=C4.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 14700ug/kg (14.7mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 35, Pg. 373, 1978.