Bicarbonate Ion → 3-(2-Acetyl-8-fluoro-3-phenyl-3a,4-dihydro-3H-pyrazolo[5,1-c][1,4]benzoxazin-3-yl)propanal
Reaction equation
[Cl:40][CH2:41][Cl:42].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:27]1)[N:7]1[CH:8]([CH2:9][O:10]2)[C:11]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)([CH2:23][CH2:24][CH2:25][OH:26])[C:12]([C:14]([CH3:15])=[O:16])=[N:13]1.[Na+:33].[Na+:34].[Na+:39].[O-:35][C:36]([OH:37])=[O:38].[S:28]([O-:29])([O-:30])(=[O:31])=[S:32]>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:27]1)[N:7]1[CH:8]([CH2:9][O:10]2)[C:11]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)([CH2:23][CH2:24][CH:25]=[O:26])[C:12]([C:14]([CH3:15])=[O:16])=[N:13]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-716971b8fbac4af09a1bc080df3cc06f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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