Hydrochloric Acid → 1-(4-Benzyloxyphenoxy)-3-[4-(2,5-dimethoxyphenyl)-1-piperazinyl]propan-2-ol
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH:15]2[CH2:16][O:17]2)[cH:18][cH:19]1.[CH3:22][O:23][c:24]1[c:25]([N:32]2[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]2)[cH:26][c:27]([O:30][CH3:31])[cH:28][cH:29]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[ClH:20].[ClH:21].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH:15]([CH2:16][N:35]2[CH2:34][CH2:33][N:32]([c:25]3[c:24]([O:23][CH3:22])[cH:29][cH:28][c:27]([O:30][CH3:31])[cH:26]3)[CH2:37][CH2:36]2)[OH:17])[cH:18][cH:19]1Participants
6
Sources & evidence
- ORD record
- ord-b2caca7d9c4a4412a8557520577bc7ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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