Hydrochloric Acid → 4-[4-[4-(2,6-Dimethylmorpholin-4-yl)phenyl]piperazin-1-yl]benzoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([c:17]3[cH:18][cH:19][c:20]([N:23]4[CH2:24][CH:25]([CH3:30])[O:26][CH:27]([CH3:29])[CH2:28]4)[cH:21][cH:22]3)[CH2:15][CH2:16]2)[cH:9][cH:10]1)=[O:31].[CH3:34][CH2:35][OH:36].[ClH:37].[Na+:33].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:32].[OH2:38]>>[O:3]=[C:4]([c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([c:17]3[cH:18][cH:19][c:20]([N:23]4[CH2:24][CH:25]([CH3:30])[O:26][CH:27]([CH3:29])[CH2:28]4)[cH:21][cH:22]3)[CH2:15][CH2:16]2)[cH:9][cH:10]1)[OH:31]Participants
8
Sources & evidence
- ORD record
- ord-7eea8eb9c13642019f3a5991015d91cb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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