2-Isopropoxy-5-methylsulfonylbenzoic acid → HCID 11719257, compound
Reaction equation
[CH3:1][c:2]1[c:3]2[c:4]([c:5]([CH3:12])[c:6]3[c:11]1[CH2:10][NH:9][CH2:8][CH2:7]3)[O:13][CH2:14][O:15]2.[CH:16]([CH3:17])([CH3:18])[O:19][c:20]1[c:21]([C:22](=[O:23])[OH:24])[cH:25][c:26]([S:29](=[O:30])(=[O:31])[CH3:32])[cH:27][cH:28]1>>[CH3:1][c:2]1[c:3]2[c:4]([c:5]([CH3:12])[c:6]3[c:11]1[CH2:10][N:9]([C:22]([c:21]1[c:20]([O:19][CH:16]([CH3:17])[CH3:18])[cH:28][cH:27][c:26]([S:29](=[O:30])(=[O:31])[CH3:32])[cH:25]1)=[O:23])[CH2:8][CH2:7]3)[O:13][CH2:14][O:15]2Participants
3
Sources & evidence
- ORD record
- ord-11ba14cef6c644178ff0ae124b43b132
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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