Sodium ion → 4-[1-(2-Isopropoxy-5-methanesulfonyl-benzoyl)-piperidin-4-yloxy]-benzonitrile
Reaction equation
[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[CH:12]([CH3:13])([CH3:14])[O:15][c:16]1[c:17]([C:18](=[O:19])[N:20]2[CH2:21][CH2:22][CH:23]([O:26][S:27]([CH3:28])(=[O:29])=[O:30])[CH2:24][CH2:25]2)[cH:31][c:32]([S:35](=[O:36])(=[O:37])[CH3:38])[cH:33][cH:34]1.[H-:10].[Na+:11].[OH:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[N:9])[cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([C:8]#[N:9])[cH:6][cH:7]1)[CH:23]1[CH2:22][CH2:21][N:20]([C:18]([c:17]2[c:16]([O:15][CH:12]([CH3:13])[CH3:14])[cH:34][cH:33][c:32]([S:35](=[O:36])(=[O:37])[CH3:38])[cH:31]2)=[O:19])[CH2:25][CH2:24]1Participants
6
Sources & evidence
- ORD record
- ord-534e4aad11514113b80484b7607ea48d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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