Ethanol → (4-{3-[(4-Fluorophenyl)sulphonyl]-4-hydroxybenzyl}-3,5-dimethylphenoxy)acetic acid
Reaction equation
[CH3:36][CH2:37][OH:38].[F:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][c:13]([CH2:14][c:15]3[c:16]([CH3:29])[cH:17][c:18]([O:19][CH2:20][C:21](=[O:22])[O:23][CH2:24][CH3:25])[cH:26][c:27]3[CH3:28])[cH:30][cH:31][c:32]2[OH:33])[cH:6][cH:7]1.[Na+:35].[OH-:34]>>[F:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][c:13]([CH2:14][c:15]3[c:16]([CH3:29])[cH:17][c:18]([O:19][CH2:20][C:21](=[O:22])[OH:23])[cH:26][c:27]3[CH3:28])[cH:30][cH:31][c:32]2[OH:33])[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-4b8b421350d64293acf279aed116fc7d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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