Sodium ion → 2-Methoxyphenyl-4-[3-(cyclohexanecarbonyl)-3-(phenyl)propyl]piperazine
Reaction equation
[C:34]([O:35][B:36]([O:37][C:38](=[O:39])[CH3:40])[O:41][C:42](=[O:43])[CH3:44])(=[O:45])[CH3:46].[CH3:19][O:20][c:21]1[c:22]([N:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[cH:23][cH:24][cH:25][cH:26]1.[CH:1]1([C:7](=[O:8])[CH:9]([CH2:10][CH:11]=[O:12])[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[H-:33].[Na+:47]>>[CH:1]1([C:7](=[O:8])[CH:9]([CH2:10][CH2:11][N:30]2[CH2:29][CH2:28][N:27]([c:22]3[c:21]([O:20][CH3:19])[cH:26][cH:25][cH:24][cH:23]3)[CH2:32][CH2:31]2)[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
6
Sources & evidence
- ORD record
- ord-83b4ba7127404274a196e36acd5aa435
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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