Acetic Acid → HCID 178436571, compound
Reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[ClH:38].[F:1][C:2]([c:3]1[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH:15]([CH3:16])[c:17]3[c:18]([NH2:22])[n:19][o:20][n:21]3)[cH:13][cH:14]2)[s:6][cH:7]1)([F:23])[F:24].[N:25](=[O:26])[O-:27].[Na+:28].[OH2:39].[S:29](=[O:30])(=[O:31])([OH:32])[OH:33]>>[F:1][C:2]([c:3]1[n:4][c:5]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH:15]([CH3:16])[c:17]3[c:18]([OH:26])[n:19][o:20][n:21]3)[cH:13][cH:14]2)[s:6][cH:7]1)([F:23])[F:24]Participants
8
Sources & evidence
- ORD record
- ord-f7cfc8573ea94940b2998b28bf2c0a5e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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