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Substance Name: Piperidinium, 1-(carboxymethyl)-1-(3-(o-chlorobenzyl)-2-butenyl)-, chloride, methyl ester
RN: 62988-45-8
InChIKey: HZWILTYSPWPTCY-QFHYWFJHSA-M

Molecular Formula

  • C19-H27-Cl-N-O2.Cl

Molecular Weight

  • 372.3333
 
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Names and Synonyms

Synonym

  • 1-(3-(o-Chlorobenzyl)-2-butenyl)-1-(methoxycarbonylmethyl)piperidinium chloride

Systematic Name

  • Piperidinium, 1-(carboxymethyl)-1-(3-(o-chlorobenzyl)-2-butenyl)-, chloride, methyl ester

Registry Numbers

CAS Registry Number

  • 62988-45-8

System Generated Number

  • 0062988458

Molecular Formulas

Molecular Formula

  • C19-H27-Cl-N-O2.Cl

Molecular Formula Fragments

  • C19-H27-Cl-N-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C19H27ClNO2.ClH/c1-16(14-17-8-4-5-9-18(17)20)10-13-21(15-19(22)23-2)11-6-3-7-12-21;/h4-5,8-10H,3,6-7,11-15H2,1-2H3;1H/q+1;/p-1/b16-10+;

InChIKey

HZWILTYSPWPTCY-QFHYWFJHSA-M

Smiles

C/C(=C\C[N+]1(CCCCC1)CC(=O)OC)/Cc2ccccc2Cl.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 28mg/kg (28mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.
rat LD50 intraperitoneal 28mg/kg (28mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.