Benzene → dihydro-4-(3,5-di tert-butyl-4-hydroxybenzylidene)-2-isopropyl-2H-1,2-oxazin-3(4H)-one
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:16]([CH:17]2[C:18](=[O:26])[N:19]([CH:23]([CH3:24])[CH3:25])[O:20][CH2:21][CH2:22]2)[OH:27])[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11].[OH2:28].[c:29]1([CH3:30])[cH:31][cH:32][c:33]([S:34]([OH:35])(=[O:36])=[O:37])[cH:38][cH:39]1.[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:16]=[C:17]2[C:18](=[O:26])[N:19]([CH:23]([CH3:24])[CH3:25])[O:20][CH2:21][CH2:22]2)[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11]Participants
5
Sources & evidence
- ORD record
- ord-5765eb20687b49a5afcc368d2a49fef9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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