Acetic Acid → (+/-)-1-{3-[2,4-Bis(methoxymethoxy)phenyl]cyclohexyl}piperazine
Reaction equation
[C:28]([O:29][BH-:30]([O:31][C:32](=[O:33])[CH3:34])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:40].[CH2:22]1[CH2:23][NH:24][CH2:25][CH2:26][NH:27]1.[CH3:1][O:2][CH2:3][O:4][c:5]1[c:6]([CH:15]2[CH2:16][C:17](=[O:21])[CH2:18][CH2:19][CH2:20]2)[cH:7][cH:8][c:9]([O:11][CH2:12][O:13][CH3:14])[cH:10]1.[CH3:41][N+:42]([CH3:43])([CH3:44])[CH3:45].[CH3:46][C:47](=[O:48])[OH:49].[Cl:50][CH:51]([Cl:52])[CH3:53]>>[CH3:1][O:2][CH2:3][O:4][c:5]1[c:6]([CH:15]2[CH2:16][CH:17]([N:24]3[CH2:23][CH2:22][NH:27][CH2:26][CH2:25]3)[CH2:18][CH2:19][CH2:20]2)[cH:7][cH:8][c:9]([O:11][CH2:12][O:13][CH3:14])[cH:10]1Participants
7
Sources & evidence
- ORD record
- ord-fd7125b8e64942f09caba45e7bbf21a6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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