Acetic Acid → 3-[2-Cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3-hydroxypropionitrile
Reaction equation
[CH3:23][C:24]#[N:25].[CH3:28][C:29](=[O:30])[OH:31].[CH:1]1([c:4]2[n:5][c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[c:12](-[c:16]3[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]3)[c:13]2[CH:14]=[O:15])[CH2:2][CH2:3]1.[H-:26].[Na+:27].[OH2:32]>>[CH:1]1([c:4]2[n:5][c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[c:12](-[c:16]3[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]3)[c:13]2[CH:14]([OH:15])[CH2:23][C:24]#[N:25])[CH2:2][CH2:3]1Participants
7
Sources & evidence
- ORD record
- ord-36d5c9022fd242a2997c25aad59b0918
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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