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Substance Name: 1-Naphthaleneethylamine, beta-(2-propenyl)-N-(2-pyrrolidinoethyl)-, bioxalate
RN: 10337-42-5
InChIKey: NIYUOWSCWVSKTE-UHFFFAOYSA-N

Molecular Formula

  • C21-H28-N2.2C2-H2-O4

Molecular Weight

  • 488.534
 
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Names and Synonyms

Synonyms

  • 4-Pentenylamine, 2-(1-naphthyl)-N-(2-pyrrolidinoethyl)-, bioxalate
  • beta-(2-Propenyl)-N-(2-pyrrolidinoethyl)-1-naphthaleneethylamine bioxalate

Systematic Name

  • 1-Naphthaleneethylamine, beta-(2-propenyl)-N-(2-pyrrolidinoethyl)-, bioxalate

Registry Numbers

CAS Registry Number

  • 10337-42-5

System Generated Number

  • 0010337425

Molecular Formulas

Molecular Formula

  • C21-H28-N2.2C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C21-H28-N2
  • COMPONENT

Structure Descriptors

InChI

1S/C21H28N2.2C2H2O4/c1-2-7-18(16-22-15-13-19-10-6-14-23-19)21-12-5-9-17-8-3-4-11-20(17)21;2*3-1(4)2(5)6/h2-5,8-9,11-12,18-19,22-23H,1,6-7,10,13-16H2;2*(H,3,4)(H,5,6)

InChIKey

NIYUOWSCWVSKTE-UHFFFAOYSA-N

Smiles

c12c([C@@H](C[NH2+]CC[C@@H]3CCC[NH2+]3)CC=C)cccc1cccc2.C(C(=O)[O-])(O)=O.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 38mg/kg (38mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 121, 1968.