Acetic Acid → HCID 70021476, compound
Reaction equation
[BrH:28].[C:1]([OH:2])(=[O:3])[CH3:4].[C:5]([O:6][C:7](=[O:8])[N:12]1[CH2:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([NH:22][N:23]3[CH:24]=[N:25][CH2:26][CH2:27]3)[c:19]([CH3:21])[c:20]21)([CH3:9])([CH3:10])[CH3:11].[CH2:35]([Cl:36])[Cl:37].[CH3:29][C:30](=[O:31])[OH:32].[CH3:33][OH:34]>>[NH:12]1[CH2:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([NH:22][N:23]3[CH:24]=[N:25][CH2:26][CH2:27]3)[c:19]([CH3:21])[c:20]21Participants
6
Sources & evidence
- ORD record
- ord-7cbb6511ef9445ff8b9f64f28e37801d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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