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Substance Name: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-4-(2-(dimethylamino)propyl)-2-methyl-6-nitro-, hydrochloride
RN: 57462-86-9
InChIKey: IOKHTIHZBIJKOX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-N3-O4.Cl-H

Molecular Weight

  • 329.782
 
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Names and Synonyms

  • 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-4-(2-(dimethylamino)propyl)-2-methyl-6-nitro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 57462-86-9

System Generated Number

  • 0057462869

Molecular Formulas

Molecular Formula

  • C14-H19-N3-O4.Cl-H

Molecular Formula Fragments

  • C14-H19-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H19N3O4.ClH/c1-9(15(3)4)8-16-12-7-11(17(19)20)5-6-13(12)21-10(2)14(16)18;/h5-7,9-10H,8H2,1-4H3;1H

InChIKey

IOKHTIHZBIJKOX-UHFFFAOYSA-N

Smiles

c12N(C([C@@H](C)Oc1ccc(c2)[N+](=O)[O-])=O)C[C@@H]([NH+](C)C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 150mg/kg (150mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 37, 1975.