Hydrochloric Acid → 3-Ethyl-3-(3-methoxyphenyl)azepan-2-one
Reaction equation
[CH2:25]([Br:26])[CH3:27].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:9]2[C:10](=[O:16])[NH:11][CH2:12][CH2:13][CH2:14][CH2:15]2)[cH:6][cH:7][cH:8]1.[CH:17]([CH3:18])([N-:19][CH:20]([CH3:21])[CH3:22])[CH3:23].[ClH:28].[Li+:24].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:9]2([CH2:17][CH3:18])[C:10](=[O:16])[NH:11][CH2:12][CH2:13][CH2:14][CH2:15]2)[cH:6][cH:7][cH:8]1Participants
7
Sources & evidence
- ORD record
- ord-784839ccfe0e4ec992953b190ec09d61
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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