HCID 66783354, compound → Methyl 4-oxo-2-[7-oxo-4-[3-(trifluoromethyl)phenyl]-1,4-diazepan-1-yl]butanoate
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][OH:7])[N:8]1[CH2:9][CH2:10][N:11]([c:16]2[cH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][cH:20][cH:21]2)[CH2:12][CH2:13][C:14]1=[O:15])=[O:26].[O:27]=[C:28]1[CH:29]([N:30]2[C:31](=[O:32])[CH2:33][CH2:34][N:35]([c:36]3[cH:37][cH:38][cH:39][c:40]([C:41]([F:42])([F:43])[F:44])[cH:45]3)[CH2:46][CH2:47]2)[CH2:48][CH2:49][O:50]1>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH:6]=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:16]2[cH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][cH:20][cH:21]2)[CH2:12][CH2:13][C:14]1=[O:15])=[O:26]Participants
3
Sources & evidence
- ORD record
- ord-c00f2598bb1f4bfab46d6947a4b44baa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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