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Substance Name: 1,6-Methano-2-benzazocine, 1,2,3,4,5,6-hexahydro-2-phenethyl-, oxalate
RN: 101771-79-3
InChIKey: ZWLKJPIQVOUHBB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-N.C2-H2-O4

Molecular Weight

  • 367.4425
 
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Names and Synonyms

Synonym

  • 2-Phenethyl-1,2,3,4,5,6-hexahydro-1,6-methano-2-benzazocine oxalate

Systematic Name

  • 1,6-Methano-2-benzazocine, 1,2,3,4,5,6-hexahydro-2-phenethyl-, oxalate

Registry Numbers

CAS Registry Number

  • 101771-79-3

System Generated Number

  • 0101771793

Molecular Formulas

Molecular Formula

  • C20-H23-N.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C20-H23-N
  • COMPONENT

Structure Descriptors

InChI

1S/C20H23N.C2H2O4/c1-2-7-16(8-3-1)12-14-21-13-6-9-17-15-20(21)19-11-5-4-10-18(17)19;3-1(4)2(5)6/h1-5,7-8,10-11,17,20H,6,9,12-15H2;(H,3,4)(H,5,6)

InChIKey

ZWLKJPIQVOUHBB-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CCN2CCCC3CC2c4c3cccc4.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 225mg/kg (225mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 24, Pg. 457, 1981.