Potassium Cation → 3-(2,2-Difluoro-propyl)-7-methoxy-8-nitro-2,3,4,5-tetrahydro-1H-benzo[d]azepine
Reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH3:31][O:32][c:33]1[cH:34][c:35]2[c:36]([cH:42][c:43]1[N+:44](=[O:45])[O-:46])[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]2.[CH3:7][C:8]#[N:9].[F:10][C:11]([S:12]([O:13][S:14]([C:15]([F:16])([F:17])[F:18])(=[O:19])=[O:20])(=[O:21])=[O:22])([F:23])[F:24].[F:1][C:2]([CH2:3][OH:4])([CH3:5])[F:6].[K+:29].[K+:30].[cH:47]1[cH:48][cH:49][n:50][cH:51][cH:52]1>>[F:1][C:2]([CH2:3][N:39]1[CH2:38][CH2:37][c:36]2[c:35]([cH:34][c:33]([O:32][CH3:31])[c:43]([N+:44](=[O:45])[O-:46])[cH:42]2)[CH2:41][CH2:40]1)([CH3:5])[F:6]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-563260a1abbd4e3cba08022d110ee49a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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