Water → HCID 69589285, compound
Reaction equation
[C:1](=[CH2:2])([CH3:3])[c:4]1[c:5]([CH:19]([CH3:20])[CH3:21])[n:6][c:7](-[c:9]2[cH:10][cH:11][c:12]([C:15]([F:16])([F:17])[F:18])[cH:13][cH:14]2)[o:8]1.[CH3:31][O:32][C:33]([CH2:34][O:35][c:36]1[c:37]([CH3:43])[cH:38][c:39]([Br:42])[cH:40][cH:41]1)=[O:44].[CH3:68][N:69]([CH3:70])[CH:71]=[O:72].[CH:22]12[CH2:23][CH2:24][CH2:25][CH:26]([BH:27]1)[CH2:28][CH2:29][CH2:30]2.[Cl:45][CH2:46][Cl:47].[O:73]1[CH2:74][CH2:75][CH2:76][CH2:77]1.[OH2:67].[cH:48]1[cH:49][cH:50][c:51]([As:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66]1>>[CH:1]([CH2:2][c:39]1[cH:38][c:37]([CH3:43])[c:36]([O:35][CH2:34][C:33]([O:32][CH3:31])=[O:44])[cH:41][cH:40]1)([CH3:3])[c:4]1[c:5]([CH:19]([CH3:20])[CH3:21])[n:6][c:7](-[c:9]2[cH:10][cH:11][c:12]([C:15]([F:16])([F:17])[F:18])[cH:13][cH:14]2)[o:8]1Participants
9
Sources & evidence
- ORD record
- ord-ae93856a955841ee8b63601b1070ff4d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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