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Substance Name: Nipecotic acid, 1-(3-indolylmethyl)-, ethyl ester
RN: 101602-77-1
InChIKey: KQXOXXXVFSNDET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H22-N2-O2

Molecular Weight

  • 286.373
 
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Names and Synonyms

Synonyms

  • 1-(3-Indolylmethyl)nipecotic acid ethyl ester
  • 4-22-00-04311 (Beilstein Handbook Reference)
  • BRN 0291764

Systematic Name

  • Nipecotic acid, 1-(3-indolylmethyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 101602-77-1

System Generated Number

  • 0101602771

Structure Descriptors

InChI

1S/C17H22N2O2/c1-2-21-17(20)13-6-5-9-19(11-13)12-14-10-18-16-8-4-3-7-15(14)16/h3-4,7-8,10,13,18H,2,5-6,9,11-12H2,1H3

InChIKey

KQXOXXXVFSNDET-UHFFFAOYSA-N

Smiles

c12c(C[N@@]3C[C@@H](CCC3)C(OCC)=O)c[nH]c1cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 54mg/kg (54mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 105, Pg. 130, 1952.