Acetic Acid → 2-(4-(Methylsulfinyl)phenoxy)-5-nitrobenzonitrile
Reaction equation
[CH3:1][S:2][c:3]1[cH:4][cH:5][c:6]([O:7][c:8]2[c:9]([C:10]#[N:11])[cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]2)[cH:19][cH:20]1.[CH3:24][C:25](=[O:26])[OH:27].[OH2:23].[OH:21][OH:22]>>[CH3:1][S:2]([c:3]1[cH:4][cH:5][c:6]([O:7][c:8]2[c:9]([C:10]#[N:11])[cH:12][c:13]([N+:16](=[O:17])[O-:18])[cH:14][cH:15]2)[cH:19][cH:20]1)=[O:21]Participants
5
Sources & evidence
- ORD record
- ord-92b3b2b4c4d3447abcad2ceee67fe2b6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…