Toluene → HCID 72333738, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([OH:8])[cH:6][cH:7]1.[C:9]([CH3:10])([CH3:11])([CH3:12])[O:13][C:14]([NH:15][CH2:16][CH:17]([CH3:18])[OH:19])=[O:20].[CH3:56][c:57]1[cH:58][cH:59][cH:60][cH:61][cH:62]1.[N:40]([C:41]([O:42][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:47])=[N:48][C:49]([O:50][C:51]([CH3:52])([CH3:53])[CH3:54])=[O:55].[c:21]1([P:22]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([O:8][CH:17]([CH2:16][NH:15][C:14]([O:13][C:9]([CH3:10])([CH3:11])[CH3:12])=[O:20])[CH3:18])[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-a86244acb03246f789179314c9cc5486
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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