Ethyl Acetate → 1-(4-Aminophenyl)-5-isobutyl-3-n-propyl-3-azabicyclo[3.1.1]heptane-2,4-dione
Reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[C:5]12[C:6](=[O:25])[N:7]([CH2:22][CH2:23][CH3:24])[C:8](=[O:21])[C:9]([c:12]3[cH:13][cH:14][c:15]([N+:18]([O-:19])=[O:20])[cH:16][cH:17]3)([CH2:10]1)[CH2:11]2.[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[C:5]12[C:6](=[O:25])[N:7]([CH2:22][CH2:23][CH3:24])[C:8](=[O:21])[C:9]([c:12]3[cH:13][cH:14][c:15]([NH2:18])[cH:16][cH:17]3)([CH2:10]1)[CH2:11]2Participants
3
Sources & evidence
- ORD record
- ord-15bdac0bfd654164a3a4e9129d2ccf9d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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