Ethyl Acetate → 1-(3,3,3-Trifluoro-2-hydroxy-2-methylpropanoylamino)-6,11-dihydrodibenz[b,e]oxepin-11-one
Reaction equation
[CH3:32][C:33]([N:34]([CH3:35])[CH3:36])=[O:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[F:1][C:2]([C:3]([C:4](=[O:5])[OH:6])([CH3:7])[OH:8])([F:9])[F:10].[NH2:15][c:16]1[cH:17][cH:18][cH:19][c:20]2[c:26]1[C:25](=[O:27])[c:24]1[c:23]([cH:31][cH:30][cH:29][cH:28]1)[CH2:22][O:21]2.[S:11]([Cl:12])([Cl:13])=[O:14]>>[F:1][C:2]([C:3]([C:4](=[O:5])[NH:15][c:16]1[cH:17][cH:18][cH:19][c:20]2[c:26]1[C:25](=[O:27])[c:24]1[c:23]([cH:31][cH:30][cH:29][cH:28]1)[CH2:22][O:21]2)([CH3:7])[OH:8])([F:9])[F:10]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-88ae6cd13976423ba3d28a3765c26062
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…