Water → HCID 59200747, compound
Reaction equation
[CH3:22][c:23]1[nH:24][c:25]2[cH:26][cH:27][c:28]([OH:33])[c:29]([F:32])[c:30]2[cH:31]1.[CH3:34][N:35]([c:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1)[CH3:42].[CH3:49][CH2:50][O:51][C:52]([CH3:53])=[O:54].[Cl:1][c:2]1[cH:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[c:9]([O:12][CH3:13])[cH:10][c:11]12.[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[OH2:55]>>[c:2]1([O:33][c:28]2[cH:27][cH:26][c:25]3[nH:24][c:23]([CH3:22])[cH:31][c:30]3[c:29]2[F:32])[cH:3][cH:4][n:5][c:6]2[cH:7][c:8]([O:14][CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[c:9]([O:12][CH3:13])[cH:10][c:11]12Participants
7
Sources & evidence
- ORD record
- ord-5661e75f251e497db5a025b01c63a26b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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