Ethanol → 6-nitro-2,2,3-trimethyl-4-(2-oxo-1,2-dihydropyridin-1-yl)-3,4-dihydro-3-hydroxy-2H-1-benzopyran
Reaction equation
[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[CH3:32][CH2:33][OH:34].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:17]1)[CH:9]1[C:10]([CH3:16])([C:11]([CH3:13])([CH3:14])[O:12]2)[O:15]1.[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[OH2:25].[nH:18]1[c:19](=[O:24])[cH:20][cH:21][cH:22][cH:23]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:17]1)[CH:9]([n:18]1[c:19](=[O:24])[cH:20][cH:21][cH:22][cH:23]1)[C:10]([OH:15])([CH3:16])[C:11]([CH3:13])([CH3:14])[O:12]2Participants
7
Sources & evidence
- ORD record
- ord-2a0b4cd31afc45feaf91c334e98ad9d2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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