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Substance Name: LJ 2162
RN: 70424-79-2
InChIKey: CTJDTGZCMKOVPH-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H31-N-O.C4-H4-O4

Molecular Weight

  • 381.509
 
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Names and Synonyms

Results Name

  • LJ 2162

Synonyms

  • (1-(N-Diethylamino)-2-(3-caren-2-yl-methoxy)) ethane maleate
  • (1-(N-Diethylamino)-2-(3-caren-2-yl-methoxy)) ethane maleate [French]
  • EINECS 274-603-4
  • LJ 2162

Systematic Names

  • Diethyl(2-((3,7,7-trimethylbicyclo(4.1.0)hept-3-en-2-yl)methoxy)ethyl)ammonium (Z)-2-butenedioate (1:1)
  • Ethanamine, N,N-diethyl-2-((3,7,7-trimethylbicyclo(4.1.0)hept-3-en-2-yl)methoxy)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 70424-79-2

System Generated Number

  • 0070424792

Molecular Formulas

Molecular Formula

  • C17-H31-N-O.C4-H4-O4

Molecular Formula Fragments

  • C17-H31-N-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H31NO.C4H4O4/c1-6-18(7-2)10-11-19-12-14-13(3)8-9-15-16(14)17(15,4)5;5-3(6)1-2-4(7)8/h8,14-16H,6-7,9-12H2,1-5H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

CTJDTGZCMKOVPH-WLHGVMLRSA-N

Smiles

C(\C=C\C(=O)O)(=O)O.C(COC[C@@H]1[C@@H]2C([C@@H]2CC=C1C)(C)C)N(CC)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 21mg/kg (21mg/kg)   French Demande Patent Document. Vol. #2381742,
mouse LD50 oral 575mg/kg (575mg/kg)   French Demande Patent Document. Vol. #2381742,
mouse LD50 subcutaneous 207mg/kg (207mg/kg)   French Demande Patent Document. Vol. #2381742,