Acetic Acid → 4-Isopropyl-6-methoxysaccharin
Reaction equation
[CH3:23][C:24](=[O:25])[OH:26].[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:7](=[O:8])[N:9]([CH2:10][CH3:11])[CH2:12][CH3:13])[c:14]([CH:20]([CH3:21])[CH3:22])[cH:15][c:16]([O:18][CH3:19])[cH:17]1>>[S:2]1(=[O:3])(=[O:4])[c:5]2[c:6]([c:14]([CH:20]([CH3:21])[CH3:22])[cH:15][c:16]([O:18][CH3:19])[cH:17]2)[C:7](=[O:8])[NH:9]1Participants
3
Sources & evidence
- ORD record
- ord-baa56434fb0d4cc6a714187fc834693c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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