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Substance Name: Carbanilic acid, o-methyl-, N-ethyl-3-pyrrolidinyl ester, oxalate
RN: 33472-71-8
InChIKey: KRMIFNSJPWRCNE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-N2-O2.C2-H2-O4

Molecular Weight

  • 338.358
 
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Names and Synonyms

Synonym

  • o-Methylcarbanilic acid N-ethyl-3-pyrrolidinyl ester oxalate

Systematic Name

  • Carbanilic acid, o-methyl-, N-ethyl-3-pyrrolidinyl ester, oxalate

Registry Numbers

CAS Registry Number

  • 33472-71-8

System Generated Number

  • 0033472718

Molecular Formulas

Molecular Formula

  • C14-H20-N2-O2.C2-H2-O4

Molecular Formula Fragments

  • C14-H20-N2-O2
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H20N2O2.C2H2O4/c1-3-16-9-8-12(10-16)18-14(17)15-13-7-5-4-6-11(13)2;3-1(4)2(5)6/h4-7,12H,3,8-10H2,1-2H3,(H,15,17);(H,3,4)(H,5,6)

InChIKey

KRMIFNSJPWRCNE-UHFFFAOYSA-N

Smiles

C1[C@@H](OC(=O)Nc2c(cccc2)C)CC[N@@H+]1CC.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 63mg/kg (63mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 710, 1971.
mouse LD50 subcutaneous 158mg/kg (158mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 710, 1971.