Water → HCID 59175897, compound
Reaction equation
[Cl:50][CH2:51][Cl:52].[NH2:17][c:18]1[c:19]([F:48])[cH:20][c:21]([CH2:22][N:23]2[CH2:24][CH2:25][N:26]([CH2:29][c:30]3[cH:31][cH:32][c:33]([C:36]([C:37]([F:38])([F:39])[F:40])([C:41]([F:42])([F:43])[F:44])[OH:45])[cH:34][cH:35]3)[CH2:27][CH2:28]2)[cH:46][cH:47]1.[O:53]1[CH2:54][CH2:55][O:56][CH2:57][CH2:58]1.[OH2:49].[n:1]1[cH:2][cH:3][c:4]([NH:7][C:8]([O:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)=[O:16])[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([NH:7][C:8](=[O:16])[NH:17][c:18]2[c:19]([F:48])[cH:20][c:21]([CH2:22][N:23]3[CH2:24][CH2:25][N:26]([CH2:29][c:30]4[cH:31][cH:32][c:33]([C:36]([C:37]([F:38])([F:39])[F:40])([C:41]([F:42])([F:43])[F:44])[OH:45])[cH:34][cH:35]4)[CH2:27][CH2:28]3)[cH:46][cH:47]2)[cH:5][cH:6]1Participants
6
Sources & evidence
- ORD record
- ord-e500f7dffd7c4ea1ab43b25254741915
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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