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Substance Name: 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-6-chloro-2-methyl-4-(2-(methylamino)propyl)-, oxalate
RN: 57462-96-1
InChIKey: ZTYFFZPRLMVIPZ-UHFFFAOYSA-N

Molecular Formula

  • C13-H17-Cl-N2-O2.C2-H2-O4

Molecular Weight

  • 358.776
 
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Names and Synonyms

Synonym

  • 6-Chloro-2-methyl-4-(2-(methylamino)propyl)-2,3-dihydro-4H-1,4-benzoxazin-3-one oxalate

Systematic Name

  • 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-6-chloro-2-methyl-4-(2-(methylamino)propyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 57462-96-1

System Generated Number

  • 0057462961

Molecular Formulas

Molecular Formula

  • C13-H17-Cl-N2-O2.C2-H2-O4

Molecular Formula Fragments

  • C13-H17-Cl-N2-O2
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C13H17ClN2O2.C2H2O4/c1-8(15-3)7-16-11-6-10(14)4-5-12(11)18-9(2)13(16)17;3-1(4)2(5)6/h4-6,8-9,15H,7H2,1-3H3;(H,3,4)(H,5,6)

InChIKey

ZTYFFZPRLMVIPZ-UHFFFAOYSA-N

Smiles

c12N(C([C@@H](C)Oc1ccc(Cl)c2)=O)C[C@@H]([NH2+]C)C.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 250mg/kg (250mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 37, 1975.