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Substance Name: 1-Naphthaleneacetonitrile, alpha-ethyl-alpha-(2-piperidinoethyl)-
RN: 2828-06-0
InChIKey: OBLJBUXADXHZIZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2

Molecular Weight

  • 306.45
 
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Names and Synonyms

Synonyms

  • 5-20-03-00085 (Beilstein Handbook Reference)
  • alpha-Ethyl-alpha-(2-piperidinoethyl)-1-naphthaleneacetonitrile
  • BRN 1352629

Systematic Name

  • 1-Naphthaleneacetonitrile, alpha-ethyl-alpha-(2-piperidinoethyl)-

Registry Numbers

CAS Registry Number

  • 2828-06-0

System Generated Number

  • 0002828060

Structure Descriptors

InChI

1S/C21H26N2/c1-2-21(17-22,13-16-23-14-6-3-7-15-23)20-12-8-10-18-9-4-5-11-19(18)20/h4-5,8-12H,2-3,6-7,13-16H2,1H3

InChIKey

OBLJBUXADXHZIZ-UHFFFAOYSA-N

Smiles

c1([C@@](CCN2CCCCC2)(CC)C#N)c2c(ccc1)cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 589, 1965.