Acetic Acid → HCID 22145850, compound
Reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[Cl:1][c:2]1[c:3]([NH:12][C:13]([c:14]2[cH:15][c:16]([O:22][CH:23]3[CH2:24][CH2:25][CH2:26][CH2:27]3)[c:17]([O:20][CH3:21])[cH:18][cH:19]2)=[O:28])[c:4]([Cl:11])[cH:5][c:6]([N+:8]([O-:9])=[O:10])[cH:7]1.[Fe:39].[Na+:29].[Na+:30].[O-:31][C:32](=[O:33])[O-:34]>>[Cl:1][c:2]1[c:3]([NH:12][C:13]([c:14]2[cH:15][c:16]([O:22][CH:23]3[CH2:24][CH2:25][CH2:26][CH2:27]3)[c:17]([O:20][CH3:21])[cH:18][cH:19]2)=[O:28])[c:4]([Cl:11])[cH:5][c:6]([NH2:8])[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-2245e1d4ec2d41b5937b2f80245251d3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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