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Substance Name: 2-Naphthaleneacetic acid, alpha-(2-naphthyl)-, 2-(diethylamino)ethyl ester, hydrochloride
RN: 63905-79-3
InChIKey: CNCOQPXJERKGEX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H29-N-O2.Cl-H

Molecular Weight

  • 448.003
 
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Names and Synonyms

Synonym

  • alpha-(2-Naphthyl)-2-naphthaleneacetic acid 2-(diethylamino)ethyl ester hydrochloride

Systematic Name

  • 2-Naphthaleneacetic acid, alpha-(2-naphthyl)-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 63905-79-3

System Generated Number

  • 0063905793

Molecular Formulas

Molecular Formula

  • C28-H29-N-O2.Cl-H

Molecular Formula Fragments

  • C28-H29-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H29NO2.ClH/c1-3-29(4-2)17-18-31-28(30)27(25-15-13-21-9-5-7-11-23(21)19-25)26-16-14-22-10-6-8-12-24(22)20-26;/h5-16,19-20,27H,3-4,17-18H2,1-2H3;1H

InChIKey

CNCOQPXJERKGEX-UHFFFAOYSA-N

Smiles

c1(C(c2cc3c(cccc3)cc2)C(OCC[NH+](CC)CC)=O)cc2c(cccc2)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 630mg/kg (630mg/kg)   Journal of the American Chemical Society. Vol. 65, Pg. 262, 1943.