Citric Acid → 5-(4-Chlorophenyl)-6-(cyclopropylmethoxy)nicotinic acid
Reaction equation
[CH3:38][S:39]([CH3:40])=[O:41].[Cl:1][c:2]1[n:3][cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]1-[c:11]1[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]1.[K+:24].[OH-:23].[OH:18][CH2:19][CH:20]1[CH2:21][CH2:22]1.[OH:25][C:26]([CH2:27][C:28]([C:29](=[O:30])[OH:31])([CH2:32][C:33](=[O:34])[OH:35])[OH:36])=[O:37]>>[c:2]1([O:18][CH2:19][CH:20]2[CH2:21][CH2:22]2)[n:3][cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]1-[c:11]1[cH:12][cH:13][c:14]([Cl:17])[cH:15][cH:16]1Participants
7
Sources & evidence
- ORD record
- ord-736f183e716e411499ef35d88c8f1e6c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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