Acetic Acid → Methyl 4-{[(4-tert-butylcyclohexyl)amino]methyl}benzoate
Reaction equation
[C:27]([BH3-:28])#[N:29].[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([CH:10]=[N:11][CH:12]2[CH2:13][CH2:14][CH:15]([C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:16][CH2:17]2)[cH:8][cH:9]1)=[O:22].[CH3:23][C:24](=[O:25])[OH:26].[CH3:31][OH:32].[Na+:30]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([CH2:10][NH:11][CH:12]2[CH2:13][CH2:14][CH:15]([C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:16][CH2:17]2)[cH:8][cH:9]1)=[O:22]Participants
6
Sources & evidence
- ORD record
- ord-e853d6a5e228402a85d1599264e49c6c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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