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Substance Name: 1-Indancarboxylic acid, 5-cyclohexyl-, N-methyl-4-piperidyl ester, hydrochloride, (+-)-
RN: 29075-61-4
InChIKey: KQUFNWNGQCSKFH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H31-N-O2.Cl-H

Molecular Weight

  • 377.9528
 
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Names and Synonyms

Synonym

  • N-Methyl-4-piperidyl (+-)-5-cyclohexylindan-1-carboxylate

Systematic Name

  • 1-Indancarboxylic acid, 5-cyclohexyl-, N-methyl-4-piperidyl ester, hydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 29075-61-4

System Generated Number

  • 0029075614

Molecular Formulas

Molecular Formula

  • C22-H31-N-O2.Cl-H

Molecular Formula Fragments

  • C22-H31-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H31NO2.ClH/c1-23-13-11-19(12-14-23)25-22(24)21-10-8-18-15-17(7-9-20(18)21)16-5-3-2-4-6-16;/h7,9,15-16,19,21H,2-6,8,10-14H2,1H3;1H

InChIKey

KQUFNWNGQCSKFH-UHFFFAOYSA-N

Smiles

CN1CCC(CC1)OC(=O)C2CCc3c2ccc(c3)C4CCCCC4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 572mg/kg (572mg/kg) GASTROINTESTINAL: OTHER CHANGES Journal of Medicinal Chemistry. Vol. 15, Pg. 1297, 1972.