Acetic Acid → 2,2-dimethyl-6-nitro-2H-1-benzopyran-4-carboxylic acid
Reaction equation
[C:1]([C:2]1=[CH:4][C:5]([CH3:16])([CH3:17])[O:6][c:7]2[c:8]1[cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]2)#[N:3].[CH3:18][C:19]([OH:20])=[O:21].[OH2:27].[S:22](=[O:23])(=[O:24])([OH:25])[OH:26]>>[CH:4]1=[C:18]([C:19]([OH:20])=[O:21])[c:8]2[c:7]([cH:12][cH:11][c:10]([N+:13](=[O:14])[O-:15])[cH:9]2)[O:6][C:5]1([CH3:16])[CH3:17]Participants
5
Sources & evidence
- ORD record
- ord-cc079f24afd64f0283c954375e8c1ed4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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