p-(Methylsulphonyl)benzoic acid → HCID 178465967, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[C:5](=[O:16])[CH2:6][c:7]2[cH:8][c:9]([C:13]([CH3:14])=[O:15])[cH:10][cH:11][c:12]21.[CH3:17][S:18](=[O:19])(=[O:20])[c:21]1[cH:22][cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:28][cH:29]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[C:5](=[O:16])[C:6](=[C:25]([c:24]2[cH:23][cH:22][c:21]([S:18]([CH3:17])(=[O:19])=[O:20])[cH:29][cH:28]2)[OH:26])[c:7]2[cH:8][c:9]([C:13]([CH3:14])=[O:15])[cH:10][cH:11][c:12]21Participants
3
Sources & evidence
- ORD record
- ord-ad4a4f4f39354314a02cb485065af285
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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