4-(N-Allyl-N-tert-butoxycarbonylamino)-2,6-dimethoxybenzeneboronic acid → HCID 178457999, compound
Reaction equation
[CH2:1]([CH:2]=[CH2:3])[N:4]([C:5](=[O:6])[O:7][C:8]([CH3:9])([CH3:10])[CH3:11])[c:12]1[cH:13][c:14]([O:23][CH3:24])[c:15]([B:20]([OH:21])[OH:22])[c:16]([O:18][CH3:19])[cH:17]1.[CH3:25][O:26][C:27]([CH:28]([NH:29][C:30]([c:31]1[c:32]([Cl:38])[cH:33][cH:34][cH:35][c:36]1[Cl:37])=[O:39])[CH2:40][c:41]1[cH:42][cH:43][c:44]([O:47][S:48]([C:49]([F:50])([F:51])[F:52])(=[O:53])=[O:54])[cH:45][cH:46]1)=[O:55]>>[CH2:1]([CH:2]=[CH2:3])[N:4]([C:5](=[O:6])[O:7][C:8]([CH3:9])([CH3:10])[CH3:11])[c:12]1[cH:13][c:14]([O:23][CH3:24])[c:15](-[c:44]2[cH:43][cH:42][c:41]([CH2:40][CH:28]([C:27]([O:26][CH3:25])=[O:55])[NH:29][C:30]([c:31]3[c:32]([Cl:38])[cH:33][cH:34][cH:35][c:36]3[Cl:37])=[O:39])[cH:46][cH:45]2)[c:16]([O:18][CH3:19])[cH:17]1Participants
3
Sources & evidence
- ORD record
- ord-8bfdd367726640e09418b8da256f3ded
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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