Acetic Acid → 4-(3-Isopropyl-1H-indol-5-yloxy)-3,5-bis-trifluoromethylphenylacetic acid
Reaction equation
[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[CH3:43][C:44]([OH:45])=[O:46].[CH:7]([CH3:8])([CH3:9])[c:10]1[cH:11][nH:12][c:13]2[cH:14][cH:15][c:16]([O:19][c:20]3[c:21]([C:33]([F:34])([F:35])[F:36])[cH:22][c:23]([CH2:30][C:31]#[N:32])[cH:24][c:25]3[C:26]([F:27])([F:28])[F:29])[cH:17][c:18]12.[OH2:6].[S:1](=[O:2])(=[O:3])([OH:4])[OH:5]>>[CH:7]([CH3:8])([CH3:9])[c:10]1[cH:11][nH:12][c:13]2[cH:14][cH:15][c:16]([O:19][c:20]3[c:21]([C:33]([F:34])([F:35])[F:36])[cH:22][c:23]([CH2:43][C:44]([OH:45])=[O:46])[cH:24][c:25]3[C:26]([F:27])([F:28])[F:29])[cH:17][c:18]12Participants
6
Sources & evidence
- ORD record
- ord-ee3501eebedd49e497bcd846da92b838
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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