Ethanol → Ethyl 1-benzyl-4-(4-chloro-2-(3-ethoxy-3-oxoprop-1-ynyl)phenyl)piperidine-4-carboxylate
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])([c:19]2[c:20]([C:26]#[C:27][C:28]([O:29][CH2:30][CH3:31])([O:32][CH2:36][CH3:37])[O:33][CH2:34][CH3:35])[cH:21][c:22]([Cl:25])[cH:23][cH:24]2)[CH2:12][CH2:13]1.[CH3:50][CH2:51][OH:52].[OH2:38].[OH2:53].[c:39]1([CH3:40])[cH:41][cH:42][c:43]([S:44]([OH:45])(=[O:46])=[O:47])[cH:48][cH:49]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])([c:19]2[c:20]([C:26]#[C:27][C:28]([O:29][CH2:30][CH3:31])=[O:32])[cH:21][c:22]([Cl:25])[cH:23][cH:24]2)[CH2:12][CH2:13]1Participants
5
Sources & evidence
- ORD record
- ord-103cdb869daa4975ad187a9bc2b50d21
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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