Toluene → HCID 67105914, compound
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([O:11][c:12]2[c:13]([CH2:19][NH:20][CH:21]([CH2:22][OH:23])[c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)[cH:14][c:15]([Br:18])[cH:16][cH:17]2)[cH:8][cH:9][cH:10]1)=[O:30].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[Cl:38][C:39]([Cl:40])=[O:41]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([O:11][c:12]2[c:13]([CH2:19][N:20]3[CH:21]([c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[CH2:22][O:23][C:39]3=[O:41])[cH:14][c:15]([Br:18])[cH:16][cH:17]2)[cH:8][cH:9][cH:10]1)=[O:30]Participants
6
Sources & evidence
- ORD record
- ord-8445e39e9f7f4f1193c0a1a9a7084f8e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…