Ethyl Acetate → 4-(3-Chloropropyl)-8-isopropyl-4H-benzo[1,4]oxazin-3-one
Reaction equation
[C:15](=[O:16])([O-:17])[O-:18].[CH3:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][cH:7][c:8]2[c:13]1[O:12][CH2:11][C:10](=[O:14])[NH:9]2.[Cl:21][CH2:22][CH2:23][CH2:24][I:25].[Cs+:19].[Cs+:20]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][cH:7][c:8]2[c:13]1[O:12][CH2:11][C:10](=[O:14])[N:9]2[CH2:24][CH2:23][CH2:22][Cl:21]Participants
7
Sources & evidence
- ORD record
- ord-225e67864c28455a994db50c8535fb7f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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