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Substance Name: 4-Isoxazolecarboxylic acid, 5-methyl-3-(5-nitro-2-furyl)-, 1-methyl-4-piperidyl ester
RN: 21787-36-0
InChIKey: VTMTVCHHVCVAQT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-N3-O6

Molecular Weight

  • 335.314
 
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Names and Synonyms

Synonym

  • 5-Methyl-3-(5-nitro-2-furyl)-4-isoxazolecarboxylic acid 1-methyl-4-piperidyl ester

Systematic Name

  • 4-Isoxazolecarboxylic acid, 5-methyl-3-(5-nitro-2-furyl)-, 1-methyl-4-piperidyl ester

Registry Numbers

CAS Registry Number

  • 21787-36-0

System Generated Number

  • 0021787360

Structure Descriptors

InChI

1S/C15H17N3O6/c1-9-13(15(19)22-10-5-7-17(2)8-6-10)14(16-24-9)11-3-4-12(23-11)18(20)21/h3-4,10H,5-8H2,1-2H3

InChIKey

VTMTVCHHVCVAQT-UHFFFAOYSA-N

Smiles

c1(c2oc([N+](=O)[O-])cc2)c(C(OC2CCN(C)CC2)=O)c(C)on1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 611, 1969.