Acetic Acid → 1-Methyl-4-(1-(4-nitrophenyl)piperidin-4-yl)piperazine
Reaction equation
[C:24]([OH:25])(=[O:26])[CH3:27].[CH3:17][N:18]1[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]1.[CH3:28][OH:29].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][C:13](=[O:16])[CH2:14][CH2:15]2)[cH:8][cH:9]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][CH:13]([N:21]3[CH2:20][CH2:19][N:18]([CH3:17])[CH2:23][CH2:22]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-028eb3792e1b4e56b090b24e788bc6f0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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