Acetic Acid → HCID 178517196, compound
Reaction equation
[CH3:36][C:37](=[O:38])[OH:39].[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].[NH:13]([NH2:14])[C:15](=[O:16])[c:17]1[cH:18][cH:19][c:20]([CH2:21][NH:22][C:23]([c:24]2[cH:25][c:26]([N+:30](=[O:31])[O-:32])[cH:27][cH:28][cH:29]2)=[O:33])[cH:34][cH:35]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:14][NH:13][C:15](=[O:16])[c:17]1[cH:18][cH:19][c:20]([CH2:21][NH:22][C:23]([c:24]2[cH:25][c:26]([N+:30](=[O:31])[O-:32])[cH:27][cH:28][cH:29]2)=[O:33])[cH:34][cH:35]1Participants
4
Sources & evidence
- ORD record
- ord-4d82797a69764ada86bbdcc7307a8dbb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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