Hydrochloric Acid → 3-[4-[[4-[[5-(2-Phenylethenyl)-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]methyl]phenyl]methoxy]phenyl]propanoic acid
Reaction equation
[CH3:46][OH:47].[ClH:45].[Na+:54].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH-:53].[OH2:55].[c:1]1([CH:7]=[CH:8][c:9]2[cH:10][c:11](-[c:35]3[cH:36][cH:37][c:38]([C:41]([F:42])([F:43])[F:44])[cH:39][cH:40]3)[n:12][n:13]2[CH2:14][c:15]2[cH:16][cH:17][c:18]([CH2:19][O:20][c:21]3[cH:22][cH:23][c:24]([CH2:27][CH2:28][C:29](=[O:30])[O:31][CH3:32])[cH:25][cH:26]3)[cH:33][cH:34]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]=[CH:8][c:9]2[cH:10][c:11](-[c:35]3[cH:36][cH:37][c:38]([C:41]([F:42])([F:43])[F:44])[cH:39][cH:40]3)[n:12][n:13]2[CH2:14][c:15]2[cH:16][cH:17][c:18]([CH2:19][O:20][c:21]3[cH:22][cH:23][c:24]([CH2:27][CH2:28][C:29](=[O:30])[OH:31])[cH:25][cH:26]3)[cH:33][cH:34]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-d5ef39ec796041dc999d22611b384634
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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