Hydrochloric Acid → 7-acetyl-1-benzoxepin-3(2H)-one
Reaction equation
[C:12]([CH3:13])(=[O:14])[c:15]1[cH:16][cH:17][c:18]2[c:19]([cH:35]1)[CH:20]([S:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)(=[O:33])=[O:34])[CH2:21][C:22](=[O:25])[CH2:23][O:24]2.[Cl:38][CH2:39][Cl:40].[ClH:37].[N:1]12[CH2:2][CH2:3][CH2:4][N:5]=[C:6]1[CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]2.[OH2:36]>>[C:12]([CH3:13])(=[O:14])[c:15]1[cH:16][cH:17][c:18]2[c:19]([cH:35]1)[CH:20]=[CH:21][C:22](=[O:25])[CH2:23][O:24]2Participants
6
Sources & evidence
- ORD record
- ord-794c5d3ebbc649f2be1363c7590be1d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…