Potassium Cation → 4-[4-[3-(3-Hydroxypyrrolidin-1-yl)propoxy]phenyl]benzonitrile
Reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:39][C:40](=[O:41])[CH2:42][CH3:43].[I-:38].[K+:35].[K+:36].[K+:37].[NH2:1][CH:2]1[CH2:3][N:4]([CH2:7][CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[cH:18][cH:19][c:20]([C:23]#[N:24])[cH:21][cH:22]3)[cH:15][cH:16]2)[CH2:5][CH2:6]1.[NH:25]1[CH2:26][CH2:27][CH:28]([OH:30])[CH2:29]1>>[CH:2]1([OH:30])[CH2:3][N:4]([CH2:7][CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[cH:18][cH:19][c:20]([C:23]#[N:24])[cH:21][cH:22]3)[cH:15][cH:16]2)[CH2:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-69613659f32a47338af5072274579c49
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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