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Substance Name: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-7-chloro-4-(2-diethylaminoethyl)-2-methyl-6-nitro-, hydrochloride
RN: 57462-65-4
InChIKey: VBOVVOCVQISACR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-Cl-N3-O4.Cl-H

Molecular Weight

  • 378.254
 
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Names and Synonyms

  • 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-7-chloro-4-(2-diethylaminoethyl)-2-methyl-6-nitro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 57462-65-4

System Generated Number

  • 0057462654

Molecular Formulas

Molecular Formula

  • C15-H20-Cl-N3-O4.Cl-H

Molecular Formula Fragments

  • C15-H20-Cl-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H20ClN3O4.ClH/c1-4-17(5-2)6-7-18-13-9-12(19(21)22)11(16)8-14(13)23-10(3)15(18)20;/h8-10H,4-7H2,1-3H3;1H

InChIKey

VBOVVOCVQISACR-UHFFFAOYSA-N

Smiles

c12c(cc(Cl)c(c2)[N+](=O)[O-])O[C@@H](C)C(N1CC[NH+](CC)CC)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 700mg/kg (700mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 37, 1975.