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Substance Name: 4H-(1,4)Oxazino(4,3-a)(1,4)benzodiazepine, 1,2,4a,5-tetrahydro-9-chloro-7-phenyl-, (Z)-2-butenedioate (1:1)
RN: 75017-25-3
InChIKey: TZIMUPXHFQECHP-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-Cl-N2-O.C4-H4-O4

Molecular Weight

  • 428.8699
 
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Names and Synonyms

Synonyms

  • 1,2,4,4a-Tetrahydro-9-chlor-7-phenyl-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin-maleinat
  • 1,2,4,4a-Tetrahydro-9-chlor-7-phenyl-5H(1,4)oxazino(4,3-a)(1,4)benzodiazepin-maleinat [German]

Systematic Name

  • 4H-(1,4)Oxazino(4,3-a)(1,4)benzodiazepine, 1,2,4a,5-tetrahydro-9-chloro-7-phenyl-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 75017-25-3

System Generated Number

  • 0075017253

Molecular Formulas

Molecular Formula

  • C18-H17-Cl-N2-O.C4-H4-O4

Molecular Formula Fragments

  • C18-H17-Cl-N2-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H17ClN2O.C4H4O4/c19-14-6-7-17-16(10-14)18(13-4-2-1-3-5-13)20-11-15-12-22-9-8-21(15)17;5-3(6)1-2-4(7)8/h1-7,10,15H,8-9,11-12H2;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

TZIMUPXHFQECHP-BTJKTKAUSA-N

Smiles

c1ccc(cc1)C2=NCC3COCCN3c4c2cc(cc4)Cl.C(=C\C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2260mg/kg (2260mg/kg)   European Patent Application. Vol. #0008045,