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Substance Name: Benzeneacetic acid, alpha-methyl-4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester
RN: 109226-99-5
InChIKey: GXJUUFQOJFFNBL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-N3-O5

Molecular Weight

  • 355.3483
 
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Names and Synonyms

Synonyms

  • BRN 6004977
  • Methyl alpha-methyl-4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)benzeneacetate

Systematic Name

  • Benzeneacetic acid, alpha-methyl-4-((6-nitro-2H-1,4-benzoxazin-3-yl)amino)-, methyl ester

Registry Numbers

CAS Registry Number

  • 109226-99-5

System Generated Number

  • 0109226995

Structure Descriptors

InChI

1S/C18H17N3O5/c1-11(18(22)25-2)12-3-5-13(6-4-12)19-17-10-26-16-8-7-14(21(23)24)9-15(16)20-17/h3-9,11H,10H2,1-2H3,(H,19,20)

InChIKey

GXJUUFQOJFFNBL-UHFFFAOYSA-N

Smiles

CC(c1ccc(cc1)NC2=Nc3cc(ccc3OC2)[N+](=O)[O-])C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 25, Pg. 986, 1986.