Water → HCID 21890422, compound
Reaction equation
[CH2:43]([CH3:44])[N:45]([CH2:46][CH2:47][NH2:48])[CH2:49][CH3:50].[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[CH:51]([Cl:52])([Cl:53])[Cl:54].[Cl:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][cH:7][c:8]1[O:9][c:10]1[cH:11][cH:12][n:13][c:14]2[cH:15][c:16]([O:22][CH3:23])[c:17]([O:20][CH3:21])[cH:18][c:19]12.[Cl:31][C:32]([Cl:33])([O:34][C:35]([O:36][C:37]([Cl:38])([Cl:39])[Cl:40])=[O:41])[Cl:42].[OH2:55]>>[Cl:1][c:2]1[cH:3][c:4]([NH:5][C:35](=[O:41])[NH:48][CH2:47][CH2:46][N:45]([CH2:43][CH3:44])[CH2:49][CH3:50])[cH:6][cH:7][c:8]1[O:9][c:10]1[cH:11][cH:12][n:13][c:14]2[cH:15][c:16]([O:22][CH3:23])[c:17]([O:20][CH3:21])[cH:18][c:19]12Participants
7
Sources & evidence
- ORD record
- ord-0267b1173f4f4e5a9ce98cdb89a54e1a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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