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Substance Name: 4-Piperidinecarboxylic acid, 4-amino-1-((4-chlorophenyl)methyl)-, butyl ester, ethanedioate (1:2)
RN: 57611-84-4
InChIKey: MCTFYEKHLLWCID-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Herbicide

Molecular Formula

  • C17-H25-Cl-N2-O.2C2-H2-O4

Molecular Weight

  • 414.8833
 
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Names and Synonyms

Synonym

  • Butyl 4-amino-1-(p-chlorobenzyl)-4-piperidinecarboxylate dioxalate

Systematic Name

  • 4-Piperidinecarboxylic acid, 4-amino-1-((4-chlorophenyl)methyl)-, butyl ester, ethanedioate (1:2)

Registry Numbers

CAS Registry Number

  • 57611-84-4

System Generated Number

  • 0057611844

Molecular Formulas

Molecular Formula

  • C17-H25-Cl-N2-O.2C2-H2-O4

Molecular Formula Fragments

  • C17-H25-Cl-N2-O
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25ClN2O2.C2H2O4/c1-2-3-12-22-16(21)17(19)8-10-20(11-9-17)13-14-4-6-15(18)7-5-14;3-1(4)2(5)6/h4-7H,2-3,8-13,19H2,1H3;(H,3,4)(H,5,6)

InChIKey

MCTFYEKHLLWCID-UHFFFAOYSA-N

Smiles

CCCCOC(=O)C1(CCN(CC1)Cc2ccc(cc2)Cl)N.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 424, 1974.