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Substance Name: 4-Isoquinolinol, 3,4-dihydro-3,3-dimethyl-, acetate (ester), 2-oxide
RN: 184375-99-3
InChIKey: QPOZZORBOCMGHT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-N-O3

Molecular Weight

  • 233.2655
 
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Names and Synonyms

Synonyms

  • 3,4-Dihydro-3,3-dimethyl-4-isoquinolinol acetate (ester) 2-oxide
  • 4-Acetoxy-3,3-dimethyl-3,4-dihydroisoquinoline N-oxide

Systematic Name

  • 4-Isoquinolinol, 3,4-dihydro-3,3-dimethyl-, acetate (ester), 2-oxide

Registry Numbers

CAS Registry Number

  • 184375-99-3

System Generated Number

  • 0184375993

Structure Descriptors

InChI

1S/C13H15NO3/c1-9(15)17-12-11-7-5-4-6-10(11)8-14(16)13(12,2)3/h4-8,12H,1-3H3

InChIKey

QPOZZORBOCMGHT-UHFFFAOYSA-N

Smiles

CC(=O)OC1c2ccccc2C=N(=O)C1(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 39, Pg. 4997, 1996.