Acetic Acid → methyl 3-oxo-3,4-dihydro-2H-1,5-benzodioxepin-2-carboxylate
Reaction equation
[C:7](=[O:8])([O:9][CH3:10])[CH2:11][O:12][c:13]1[c:14]([O:19][CH2:20][C:21](=[O:22])[O:23][CH3:24])[cH:15][cH:16][cH:17][cH:18]1.[CH3:1][C:2]([CH3:3])([O-:4])[CH3:5].[CH3:25][C:26](=[O:27])[OH:28].[CH3:30][S:31]([CH3:32])=[O:33].[K+:6].[OH2:29]>>[C:7]1(=[O:8])[CH2:11][O:12][c:13]2[c:14]([cH:15][cH:16][cH:17][cH:18]2)[O:19][CH:20]1[C:21](=[O:22])[O:23][CH3:24]Participants
7
Sources & evidence
- ORD record
- ord-c9622c79476945f69d2c0fa0297e1a9c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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