rel-Methyl (3R,4S)-4-(4-chlorophenyl)-1-methyl-3-piperidinecarboxylate

CAS Registry Number®

205805-14-7
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CAS Name

rel-Methyl (3R,4S)-4-(4-chlorophenyl)-1-methyl-3-piperidinecarboxylate

Molecular Formula

C14H18ClNO2

Molecular Mass

267.75

Cite this Page

rel-Methyl (3R,4S)-4-(4-chlorophenyl)-1-methyl-3-piperidinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=205805-14-7 (retrieved 2024-07-02) (CAS RN: 205805-14-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C14H18ClNO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13+/s2

InChIKey

InChIKey=GDFVYUDIAQQDTA-QWAQRTLVNA-N

SMILES

C(OC)(=O)[C@@H]1[C@H](CCN(C)C1)C2=CC=C(Cl)C=C2

Canonical SMILES

O=C(OC)C1CN(C)CCC1C2=CC=C(Cl)C=C2

Other Names for this Substance

  • 3-Piperidinecarboxylic acid, 4-(4-chlorophenyl)-1-methyl-, methyl ester, (3R,4S)-rel-
  • 3-Piperidinecarboxylic acid, 4-(4-chlorophenyl)-1-methyl-, methyl ester, trans-
  • rel-Methyl (3R,4S)-4-(4-chlorophenyl)-1-methyl-3-piperidinecarboxylate