Citric Acid → 2-Chloro-5-(5-cyclopropyl-1H-pyrazol-3-yl)-benzoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[c:6]([Cl:19])[cH:7][cH:8][c:9](-[c:11]2[n:12][nH:13][c:14]([CH:16]3[CH2:17][CH2:18]3)[cH:15]2)[cH:10]1)=[O:20].[CH3:36][OH:37].[K+:22].[OH-:21].[OH:23][C:24]([CH2:25][C:26]([C:27](=[O:28])[OH:29])([CH2:30][C:31](=[O:32])[OH:33])[OH:34])=[O:35]>>[O:3]=[C:4]([c:5]1[c:6]([Cl:19])[cH:7][cH:8][c:9](-[c:11]2[n:12][nH:13][c:14]([CH:16]3[CH2:17][CH2:18]3)[cH:15]2)[cH:10]1)[OH:20]Participants
6
Sources & evidence
- ORD record
- ord-72b07633f007443d9f24d01b1e6925c6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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