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Substance Name: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-8-chloro-4-(2-(dimethylamino)propyl)-2-methyl-6-nitro-, hydrochloride
RN: 57462-88-1
InChIKey: ZWUQKUUAGYJBBG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-Cl-N3-O4.Cl-H

Molecular Weight

  • 364.227
 
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Names and Synonyms

  • 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-8-chloro-4-(2-(dimethylamino)propyl)-2-methyl-6-nitro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 57462-88-1

System Generated Number

  • 0057462881

Molecular Formulas

Molecular Formula

  • C14-H18-Cl-N3-O4.Cl-H

Molecular Formula Fragments

  • C14-H18-Cl-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18ClN3O4.ClH/c1-8(16(3)4)7-17-12-6-10(18(20)21)5-11(15)13(12)22-9(2)14(17)19;/h5-6,8-9H,7H2,1-4H3;1H

InChIKey

ZWUQKUUAGYJBBG-UHFFFAOYSA-N

Smiles

c12c(c(cc(c2)[N+](=O)[O-])Cl)O[C@@H](C)C(N1C[C@@H]([NH+](C)C)C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 200mg/kg (200mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 37, 1975.