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Substance Name: 1-Naphthaleneacetic acid, alpha-allyl-, 2'-(N,N-diethylamino)ethyl ester
RN: 3216-54-4
InChIKey: VCGAKFSCYYVKIR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O2

Molecular Weight

  • 325.449
 
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Names and Synonyms

Synonyms

  • 2'-(N,N-Diethylamino)ethyl alpha-allyl-1-naphthaleneacetate
  • 2-(Diethylamino)ethyl alpha-allyl-1-naphthaleneacetate
  • BRN 2001607

Systematic Name

  • 1-Naphthaleneacetic acid, alpha-allyl-, 2'-(N,N-diethylamino)ethyl ester

Registry Numbers

CAS Registry Number

  • 3216-54-4

System Generated Number

  • 0003216544

Structure Descriptors

InChI

1S/C21H27NO2/c1-4-10-20(21(23)24-16-15-22(5-2)6-3)19-14-9-12-17-11-7-8-13-18(17)19/h4,7-9,11-14,20H,1,5-6,10,15-16H2,2-3H3

InChIKey

VCGAKFSCYYVKIR-UHFFFAOYSA-N

Smiles

c1(c2c(ccc1)cccc2)[C@@H](C(OCCN(CC)CC)=O)CC=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 598, 1965.