Water → HCID 22315172, compound
Reaction equation
[CH2:38]([Cl:39])[Cl:40].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[CH:1]1([CH2:6][CH:7]([C:8](=[O:9])[OH:10])[c:11]2[cH:12][c:13]([Cl:18])[c:14]([Cl:17])[cH:15][cH:16]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl:19][C:20]([C:21]([Cl:22])=[O:23])=[O:24].[NH2:25][c:26]1[n:27][cH:28][n:29][cH:30][cH:31]1.[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[OH2:46].[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1>>[CH:1]1([CH2:6][CH:7]([C:8](=[O:10])[NH:25][c:26]2[n:27][cH:28][n:29][cH:30][cH:31]2)[c:11]2[cH:12][c:13]([Cl:18])[c:14]([Cl:17])[cH:15][cH:16]2)[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
9
Sources & evidence
- ORD record
- ord-03bb5070623b4fbfbf5b9ac2fa12e960
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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