Acetic Acid → HCID 178521266, compound
Reaction equation
[CH3:32][C:33](=[O:34])[OH:35].[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[O:12].[N+:13](=[O:14])([O-:15])[c:16]1[cH:17][c:18](-[c:22]2[n:23][n:24][n:25]([CH2:27][C:28](=[O:29])[NH:30][NH2:31])[n:26]2)[cH:19][cH:20][cH:21]1>>[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[N:31][NH:30][C:28]([CH2:27][n:25]1[n:24][n:23][c:22](-[c:18]2[cH:17][c:16]([N+:13](=[O:14])[O-:15])[cH:21][cH:20][cH:19]2)[n:26]1)=[O:29]Participants
4
Sources & evidence
- ORD record
- ord-8376469b40224f518093cb8db0ff12f5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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