Trifluoroacetic acid → [4-[2-(4-Benzyl-3-hydroxypiperidin-1-yl)ethylsulfonyl]phenyl] 4-(aminomethyl)benzoate
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[CH:9]([OH:43])[CH2:10][N:11]([CH2:14][CH2:15][S:16](=[O:17])(=[O:18])[c:19]2[cH:20][cH:21][c:22]([O:25][C:26]([c:27]3[cH:28][cH:29][c:30]([CH2:33][NH:34][C:35]([O:36][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:41])[cH:31][cH:32]3)=[O:42])[cH:23][cH:24]2)[CH2:12][CH2:13]1.[F:44][C:45]([F:46])([F:47])[C:48]([OH:49])=[O:50]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[CH:9]([OH:43])[CH2:10][N:11]([CH2:14][CH2:15][S:16](=[O:17])(=[O:18])[c:19]2[cH:20][cH:21][c:22]([O:25][C:26]([c:27]3[cH:28][cH:29][c:30]([CH2:33][NH2:34])[cH:31][cH:32]3)=[O:42])[cH:23][cH:24]2)[CH2:12][CH2:13]1Participants
3
Sources & evidence
- ORD record
- ord-2400709913c74b15abff3fe93d8b2efc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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