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Substance Name: Dibenz(b,f)(1,4)oxazepine-8-acetic acid, 10,11-dihydro-alpha-methyl-2-nitro-11-oxo-
RN: 109790-30-9
InChIKey: XVNNUQVAMNIJET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H12-N2-O6

Molecular Weight

  • 328.2788
 
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Names and Synonyms

Synonyms

  • 10,11-Dihydro-alpha-methyl-2-nitro-11-oxodibenz(b,f)(1,4)oxazepine-8-acetic acid
  • BRN 5628893
  • Propanoic acid, 2-(10,11-dihydro-2-nitro-11-oxodibenz(b,f)(1,4)oxazepin-7-yl)-

Systematic Name

  • Dibenz(b,f)(1,4)oxazepine-8-acetic acid, 10,11-dihydro-alpha-methyl-2-nitro-11-oxo-

Registry Numbers

CAS Registry Number

  • 109790-30-9

System Generated Number

  • 0109790309

Structure Descriptors

InChI

1S/C16H12N2O6/c1-8(16(20)21)9-2-4-14-12(6-9)17-15(19)11-7-10(18(22)23)3-5-13(11)24-14/h2-8H,1H3,(H,17,19)(H,20,21)

InChIKey

XVNNUQVAMNIJET-UHFFFAOYSA-N

Smiles

CC(c1ccc2c(c1)NC(=O)c3cc(ccc3O2)[N+](=O)[O-])C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1600mg/kg (1600mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 22, Pg. 161, 1987.