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Substance Name: 2,5-Cyclohexadien-1-one, 4-hydroxyimino-2-methoxy-
RN: 17576-99-7
InChIKey: XTXLIXJSHSTKNN-VMPITWQZSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C7-H7-N-O3

Molecular Weight

  • 153.136
 
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Names and Synonyms

Synonyms

  • 2,5-Cyclohexadien-1-one, 4-hydroxyimino-2-methoxy-
  • 2,5-Cyclohexadiene-1,4-dione, 2-methoxy-, 4-monooxime
  • 2-Methoxy-p-benzoquinone-4-oxime
  • 4-Hydroxyimino-2-methoxy-2,5-cyclohexadien-1-one
  • 4-Hydroxyimino-2-methoxy-2,5-cyclohexadiene-1-one
  • NSC 239649
  • p-Benzoquinone, 2-methoxy-, 4-oxime

Systematic Names

  • 2,5-Cyclohexadien-1-one, 4-hydroxyimino-2-methoxy-
  • 2,5-Cyclohexadiene-1,4-dione, 2-methoxy-, 4-oxime (9CI)

Registry Numbers

CAS Registry Number

  • 17576-99-7

System Generated Number

  • 0017576997

Structure Descriptors

InChI

1S/C7H7NO3/c1-11-7-4-5(8-10)2-3-6(7)9/h2-4,10H,1H3/b8-5+

InChIKey

XTXLIXJSHSTKNN-VMPITWQZSA-N

Smiles

C1(=C\C(C=CC1=O)=N\O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 120mg/kg (120mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 11, 1978.