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Substance Name: 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-2-methyl-, hydrochloride
RN: 63905-70-4
InChIKey: CFWATMFTYGZZAF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H20-Cl-N-O2.Cl-H

Molecular Weight

  • 354.275
 
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Names and Synonyms

Synonyms

  • 1-(4-Chlorophenethyl)-6,7-dihydroxy-2-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
  • 6,7-Isoquinolinediol, 1-(4-chlorophenethyl)-2-methyl-1,2,3,4-tetrahydro-, hydrochloride

Systematic Name

  • 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-2-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 63905-70-4

System Generated Number

  • 0063905704

Molecular Formulas

Molecular Formula

  • C18-H20-Cl-N-O2.Cl-H

Molecular Formula Fragments

  • C18-H20-Cl-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H20ClNO2.ClH/c1-20-9-8-13-10-17(21)18(22)11-15(13)16(20)7-4-12-2-5-14(19)6-3-12;/h2-3,5-6,10-11,16,21-22H,4,7-9H2,1H3;1H

InChIKey

CFWATMFTYGZZAF-UHFFFAOYSA-N

Smiles

c12c(cc(O)c(c2)O)CC[N@@H+]([C@@H]1CCc1ccc(Cl)cc1)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 70mg/kg (70mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 5, Pg. 291, 1965.