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Substance Name: 1-Naphthalenepropanoic acid, alpha-(1-naphthalenylmethyl)-, 2-(diethylamino)ethyl ester, ethanedioate (1:1)
RN: 115025-99-5
InChIKey: FYUFQXSXPVAXSS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H33-N-O2.C2-H2-O4

Molecular Weight

  • 529.6295
 
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Names and Synonyms

Synonym

  • 2-Diethylaminoethyl 1,3-bis(1-naphthyl)propane-2-carboxylate hydrogen oxalate

Systematic Name

  • 1-Naphthalenepropanoic acid, alpha-(1-naphthalenylmethyl)-, 2-(diethylamino)ethyl ester, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 115025-99-5

System Generated Number

  • 0115025995

Molecular Formulas

Molecular Formula

  • C20-H33-N-O2.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C20-H33-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C30H33NO2.C2H2O4/c1-3-31(4-2)19-20-33-30(32)27(21-25-15-9-13-23-11-5-7-17-28(23)25)22-26-16-10-14-24-12-6-8-18-29(24)26;3-1(4)2(5)6/h5-18,27H,3-4,19-22H2,1-2H3;(H,3,4)(H,5,6)

InChIKey

FYUFQXSXPVAXSS-UHFFFAOYSA-N

Smiles

CCN(CC)CCOC(=O)C(Cc1cccc2c1cccc2)Cc3cccc4c3cccc4.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 52, Pg. 2534, 1987.