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Substance Name: 4(3H)-Isoquinolinone, 3,3-dimethyl-, 2-oxide
RN: 184375-98-2
InChIKey: DKFRIHPRWJJCHM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H11-N-O2

Molecular Weight

  • 189.2129
 
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Names and Synonyms

Synonyms

  • 3,3-Dimethyl-3,4-dihydro-3H-isoquinolin-4-one n-oxide
  • 3,3-Dimethyl-4(3H)-isoquinolinone 2-oxide

Systematic Name

  • 4(3H)-Isoquinolinone, 3,3-dimethyl-, 2-oxide

Registry Numbers

CAS Registry Number

  • 184375-98-2

System Generated Number

  • 0184375982

Structure Descriptors

InChI

1S/C11H11NO2/c1-11(2)10(13)9-6-4-3-5-8(9)7-12(11)14/h3-7H,1-2H3

InChIKey

DKFRIHPRWJJCHM-UHFFFAOYSA-N

Smiles

CC1(C(=O)c2ccccc2C=[N+]1[O-])C

Toxicity

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