Calcium Cation → 2-(Benzenesulfonyl)-7-[(4-fluorophenoxy)methyl]oxepane
Reaction equation
[CH2:30]([Cl:31])[Cl:32].[Ca+2:11].[Cl-:10].[Cl-:12].[F:13][c:14]1[cH:15][cH:16][c:17]([O:18][CH2:19][CH:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH:25]=[O:26])[OH:27])[cH:28][cH:29]1.[c:1]1([S:7](=[O:8])[OH:9])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[CH:25]2[CH2:24][CH2:23][CH2:22][CH2:21][CH:20]([CH2:19][O:18][c:17]3[cH:16][cH:15][c:14]([F:13])[cH:29][cH:28]3)[O:27]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Sources & evidence
- ORD record
- ord-41d4dffa9ec74716bffef403c831b47b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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