Acetic Acid → HCID 44819482, compound
Reaction equation
[CH3:1][N:2]([C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([n:9][c:10]([NH:13][c:14]3[cH:15][cH:16][c:17]([CH:20]4[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]4)[cH:18][n:19]3)[n:11][cH:12]2)[n:26]1[CH:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1)[CH3:32].[CH3:33][C:34](=[O:35])[OH:36].[CH3:37][C:38](=[O:39])[CH3:40].[Cl:41][CH2:42][Cl:43]>>[CH3:1][N:2]([C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([n:9][c:10]([NH:13][c:14]3[cH:15][cH:16][c:17]([CH:20]4[CH2:21][CH2:22][N:23]([CH:38]([CH3:37])[CH3:40])[CH2:24][CH2:25]4)[cH:18][n:19]3)[n:11][cH:12]2)[n:26]1[CH:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1)[CH3:32]Participants
5
Sources & evidence
- ORD record
- ord-c30576f64bc846b7ab57776c33af66cc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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