AGN-PC-0ND25R → Trans 1-[4-(1,3-benzodioxol-5-yl)-1-cyclohexyl]-4-[(2-fluoro-5-methoxyphenyl)methyl]piperidine
Reaction equation
[F:17][c:18]1[c:19]([CH2:20][CH:21]2[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]2)[cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]1.[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]1[CH2:11][CH2:12][C:13](=[O:16])[CH2:14][CH2:15]1)[cH:9]2>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]1[CH2:11][CH2:12][CH:13]([N:24]3[CH2:23][CH2:22][CH:21]([CH2:20][c:19]4[c:18]([F:17])[cH:30][cH:29][c:28]([O:31][CH3:32])[cH:27]4)[CH2:26][CH2:25]3)[CH2:14][CH2:15]1)[cH:9]2Participants
3
Sources & evidence
- ORD record
- ord-4a6f4b70082a49de892ecb95051ed89b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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