SpectraBase Spectrum ID |
1XAZPxEkBD2 |
Name |
(2S,3R)-3-(4-Chlorophenyl)-N-ethyl-3-hydroxy-2-methyl-N-phenylpropanamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.118256586 u |
Formula |
C18H20ClNO2 |
InChI |
InChI=1S/C18H20ClNO2/c1-3-20(16-7-5-4-6-8-16)18(22)13(2)17(21)14-9-11-15(19)12-10-14/h4-13,17,21H,3H2,1-2H3/t13-,17+/m0/s1 |
InChIKey |
FYAQFHUKOSKXSO-SUMWQHHRSA-N |
Molecular Weight |
317.816 g/mol |
SMILES |
C([C@]([C@@](O)(C1=CC=C(C=C1)Cl)[H])(C)[H])(=O)N(C1=CC=CC=C1)CC |