Acetic Acid → HCID 58958618, compound
Reaction equation
[C:40]([OH:41])(=[O:42])[CH3:43].[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH:11][c:12]2[cH:13][c:14](-[c:24]3[cH:25][cH:26][c:27]([CH3:30])[cH:28][cH:29]3)[n:15][n:16]2-[c:17]2[c:18]([CH3:23])[cH:19][cH:20][cH:21][cH:22]2)[c:6]([C:7](=[O:8])[OH:9])[cH:10]1.[Cl:44][CH2:45][Cl:46].[Cl:47][CH2:48][Cl:49].[O:31]=[C:32]1[N:33]([I:38])[C:34](=[O:35])[CH2:36][CH2:37]1.[OH2:39]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH:11][c:12]2[c:13]([I:38])[c:14](-[c:24]3[cH:25][cH:26][c:27]([CH3:30])[cH:28][cH:29]3)[n:15][n:16]2-[c:17]2[c:18]([CH3:23])[cH:19][cH:20][cH:21][cH:22]2)[c:6]([C:7](=[O:8])[OH:9])[cH:10]1Participants
6
Sources & evidence
- ORD record
- ord-f8e9421dea544f1daf6fb6c567bfaef1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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