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CHEBI:51862 - methyl (R)-phenyl[(S)-piperidin-2-yl]acetate

ChEBI IDCHEBI:51862
ChEBI Namemethyl (R)-phenyl[(S)-piperidin-2-yl]acetate
Stars
ASCII Namemethyl (R)-phenyl[(S)-piperidin-2-yl]acetate
DefinitionA methyl phenyl(piperidin-2-yl)acetate that has R configuration α to the carbonyl group and S configuration at the stereocentre bearing the nitrogen.
Last Modified13 January 2015
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H19NO2
Net Charge0
Average Mass233.311
Monoisotopic Mass233.14158
SMILES[H][C@@]1([C@]([H])(C(=O)OC)c2ccccc2)CCCCN1
InChIInChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3/t12-,13+/m0/s1
InChIKeyDUGOZIWVEXMGBE-QWHCGFSZSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl (R)-phenyl[(S)-piperidin-2-yl]acetate (CHEBI:51862) is a methyl phenyl(piperidin-2-yl)acetate (CHEBI:84276)
methyl (R)-phenyl[(S)-piperidin-2-yl]acetate (CHEBI:51862) is enantiomer of methyl (S)-phenyl[(R)-piperidin-2-yl]acetate (CHEBI:51861)
Incoming Relation(s)
methyl (S)-phenyl[(R)-piperidin-2-yl]acetate (CHEBI:51861) is enantiomer of methyl (R)-phenyl[(S)-piperidin-2-yl]acetate (CHEBI:51862)
IUPAC Name 
methyl (2R)-phenyl[(2S)-piperidin-2-yl]acetate
Synonyms  Source
methyl (αR,2S)-phenyl-(piperidin-2-yl)acetateChEBI
erythro-(2R,2'S)-methyl phenidateChEBI
Registry NumbersSources
Reaxys:7974782Reaxys