Acetic Acid → 3-nitrodibenzothiophene S,S-dioxide
Reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[OH2:29].[OH:25][N+:26]([O-:27])=[O:28].[S:5](=[O:6])(=[O:7])([OH:8])[OH:9].[cH:10]1[cH:11][cH:12][cH:13][c:14]2[c:18]1-[c:17]1[c:16]([cH:22][cH:21][cH:20][cH:19]1)[S:15]2(=[O:23])=[O:24]>>[cH:10]1[cH:11][cH:12][cH:13][c:14]2[c:18]1-[c:17]1[c:16]([cH:22][c:21]([N+:26](=[O:25])[O-:27])[cH:20][cH:19]1)[S:15]2(=[O:23])=[O:24]Participants
6
Sources & evidence
- ORD record
- ord-3122502cc87e4d6b977a188ab4664077
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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