Bicarbonate Ion → 3-{4-[6-(4-Cyclohexyl-3-trifluoromethyl-benzyloxy)-pyridin-3-yl]-piperazin-1-yl}-propionic acid tert-butyl ester
Reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][n:16][c:17]([O:20][CH2:21][c:22]3[cH:23][c:24]([C:34]([F:35])([F:36])[F:37])[c:25]([CH:28]4[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]4)[cH:26][cH:27]3)[cH:18][cH:19]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[C:45]([CH:46]=[CH2:47])(=[O:48])[O:49][C:50]([CH3:51])([CH3:52])[CH3:53].[CH3:71][OH:72].[CH:54]([N:55]([CH2:56][CH3:57])[CH:58]([CH3:59])[CH3:60])([CH3:61])[CH3:62].[Cl:68][CH2:69][Cl:70].[Na+:67].[O-:63][C:64]([OH:65])=[O:66].[OH:38][C:39]([C:40]([F:41])([F:42])[F:43])=[O:44]>>[N:8]1([CH2:47][CH2:46][C:45](=[O:48])[O:49][C:50]([CH3:51])([CH3:52])[CH3:53])[CH2:9][CH2:10][N:11]([c:14]2[cH:15][n:16][c:17]([O:20][CH2:21][c:22]3[cH:23][c:24]([C:34]([F:35])([F:36])[F:37])[c:25]([CH:28]4[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33]4)[cH:26][cH:27]3)[cH:18][cH:19]2)[CH2:12][CH2:13]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-1108c93536e64246a25f0be7c1e0882f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…