Water → HCID 86645877, compound
Reaction equation
[CH2:41]([N:42]([CH2:43][CH3:44])[CH2:45][CH3:46])[CH3:47].[CH2:48]1[N:49]2[CH2:50][CH2:51][N:52]([CH2:53][CH2:54]2)[CH2:55]1.[Cl:13][c:14]1[c:15]([CH:21]([C:22]([C:23]([F:24])([F:25])[F:26])([OH:27])[c:28]2[cH:29][c:30]3[c:31]([n:32]([CH3:37])[c:33](=[O:36])[n:34]3[CH3:35])[cH:38][cH:39]2)[CH3:40])[cH:16][cH:17][c:18]([OH:20])[cH:19]1.[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[cH:8][cH:9][c:10]([Cl:12])[n:11]1.[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[OH2:61]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[cH:8][cH:9][c:10]([O:20][c:18]2[cH:17][cH:16][c:15]([CH:21]([C:22]([C:23]([F:24])([F:25])[F:26])([OH:27])[c:28]3[cH:29][c:30]4[c:31]([n:32]([CH3:37])[c:33](=[O:36])[n:34]4[CH3:35])[cH:38][cH:39]3)[CH3:40])[c:14]([Cl:13])[cH:19]2)[n:11]1Participants
7
Sources & evidence
- ORD record
- ord-6144ce905cf34b23bdf237f6f0708e90
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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