Hydrochloric Acid → [3-Benzhydryl-4-[[3-(trifluoromethoxy)phenyl]methoxy]piperidin-1-yl]-[3,5-bis(trifluoromethyl)phenyl]methanone
Reaction equation
[CH:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[CH:15]1[CH2:16][NH:17][CH2:18][CH2:19][CH:20]1[O:21][CH2:22][c:23]1[cH:24][c:25]([O:29][C:30]([F:31])([F:32])[F:33])[cH:26][cH:27][cH:28]1.[ClH:1].[F:34][C:35]([c:36]1[cH:37][c:38]([C:39](=[O:40])[OH:41])[cH:42][c:43]([C:45]([F:46])([F:47])[F:48])[cH:44]1)([F:49])[F:50]>>[CH:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[CH:15]1[CH2:16][N:17]([C:39]([c:38]2[cH:37][c:36]([C:35]([F:34])([F:49])[F:50])[cH:44][c:43]([C:45]([F:46])([F:47])[F:48])[cH:42]2)=[O:40])[CH2:18][CH2:19][CH:20]1[O:21][CH2:22][c:23]1[cH:24][c:25]([O:29][C:30]([F:31])([F:32])[F:33])[cH:26][cH:27][cH:28]1Participants
4
Sources & evidence
- ORD record
- ord-6d4238aace5245a29aed5b4713fe3419
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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