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Substance Name: Isoquinoline, 1,2,3,4-tetrahydro-3-methyl-8-phenyl-, hydrochloride
RN: 69381-58-4
InChIKey: VCIGSTGNWVZWQA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N.Cl-H

Molecular Weight

  • 259.778
 
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Names and Synonyms

Synonyms

  • 1,2,3,4-Tetrahydro-3-methyl-8-phenylisoquinoline hydrochloride
  • 3-Methyl-8-phenyl-1,2,3,4-tetrahydroisoquinoline hydrochloride

Systematic Name

  • Isoquinoline, 1,2,3,4-tetrahydro-3-methyl-8-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 69381-58-4

System Generated Number

  • 0069381584

Molecular Formulas

Molecular Formula

  • C16-H17-N.Cl-H

Molecular Formula Fragments

  • C16-H17-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H17N.ClH/c1-12-10-14-8-5-9-15(16(14)11-17-12)13-6-3-2-4-7-13;/h2-9,12,17H,10-11H2,1H3;1H

InChIKey

VCIGSTGNWVZWQA-UHFFFAOYSA-N

Smiles

c12c(c3ccccc3)cccc1C[C@@H](C)[NH2+]C2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 146mg/kg (146mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 977, 1980.