Ethanol → 1-(4-Amino-phenyl)-3-pentyl-3-aza-bicyclo[3.1.1]heptane-2,4-dione
Reaction equation
[CH3:24][CH2:25][OH:26].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([C:10]23[C:11](=[O:23])[N:12]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[C:13](=[O:17])[CH:14]([CH2:15]2)[CH2:16]3)[cH:8][cH:9]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([C:10]23[C:11](=[O:23])[N:12]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[C:13](=[O:17])[CH:14]([CH2:15]2)[CH2:16]3)[cH:8][cH:9]1Participants
3
Sources & evidence
- ORD record
- ord-93575f8eda1f4716aeeccb5663936b52
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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