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Substance Name: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-((((4-chlorophenyl)amino)carbonyl)oxy)-, O-2-propynyloxime, (E)-
RN: 145071-63-2
InChIKey: VWFLYEBUYPPRGE-WOJGMQOQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-Cl-N3-O3

Molecular Weight

  • 333.7734
 
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Names and Synonyms

Synonym

  • BRN 5829814

Systematic Name

  • 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-((((4-chlorophenyl)amino)carbonyl)oxy)-, O-2-propynyloxime, (E)-

Registry Numbers

CAS Registry Number

  • 145071-63-2

System Generated Number

  • 0145071632

Structure Descriptors

InChI

1S/C16H16ClN3O3/c1-2-10-22-18-11-13-4-3-9-20(12-13)23-16(21)19-15-7-5-14(17)6-8-15/h1,4-8,11H,3,9-10,12H2,(H,19,21)/b18-11+

InChIKey

VWFLYEBUYPPRGE-WOJGMQOQSA-N

Smiles

C#CCO/N=C/C1=CCCN(C1)OC(=O)Nc2ccc(cc2)Cl

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. 27, Pg. 519, 1992.