Potassium Cation → 6-((3-Fluoro-4-methoxyphenyl)ethynyl)-3,9-dimethyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
Reaction equation
[Br:39][C:40]#[C:41][c:42]1[cH:43][c:44]([F:50])[c:45]([O:48][CH3:49])[cH:46][cH:47]1.[CH3:1][N:2]1[CH2:3][CH2:4][c:5]2[nH:6][c:7]3[cH:8][cH:9][c:10]([CH3:16])[cH:11][c:12]3[c:13]2[CH2:14][CH2:15]1.[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[K+:36].[K+:37].[K+:38].[P:31]([O-:32])([O-:33])([O-:34])=[O:35].[cH:17]1[cH:18][c:19]2[cH:20][cH:21][c:22]3[c:23]([c:24]2[n:25][cH:26]1)[n:27][cH:28][cH:29][cH:30]3>>[CH3:1][N:2]1[CH2:3][CH2:4][c:5]2[n:6]([C:40]#[C:41][c:42]3[cH:43][c:44]([F:50])[c:45]([O:48][CH3:49])[cH:46][cH:47]3)[c:7]3[cH:8][cH:9][c:10]([CH3:16])[cH:11][c:12]3[c:13]2[CH2:14][CH2:15]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-90727bfd4a9a4c5999fc37dcd63eca70
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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