Acetic Acid → HCID 13881467, compound
Reaction equation
[CH3:10][c:11]1[c:12]([N:18]2[C:19](=[NH:31])[N:20]([c:23]3[c:24]([CH3:30])[cH:25][cH:26][cH:27][c:28]3[CH3:29])[CH2:21][CH2:22]2)[c:13]([CH3:17])[cH:14][cH:15][cH:16]1.[CH3:41][C:42](=[O:43])[OH:44].[CH:1]([O:2][C:4]([CH3:3])=[O:6])=[O:5].[CH:37]([Cl:38])([Cl:39])[Cl:40].[CH:7]([OH:8])=[O:9].[Na+:32].[OH:33][C:34](=[O:35])[O-:36]>>[CH:4](=[O:6])[N:31]=[C:19]1[N:18]([c:12]2[c:11]([CH3:10])[cH:16][cH:15][cH:14][c:13]2[CH3:17])[CH2:22][CH2:21][N:20]1[c:23]1[c:24]([CH3:30])[cH:25][cH:26][cH:27][c:28]1[CH3:29]Participants
8
Sources & evidence
- ORD record
- ord-9445978f49f148c4a53e51110e85c21b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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