Acetic Acid → HCID 178477843, compound
Reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10](-[c:16]2[c:17]([C:21]#[N:22])[n:18][nH:19][cH:20]2)[cH:11][cH:12][c:13]([Cl:15])[cH:14]1.[CH3:23][C:24](=[O:25])[OH:26]>>[C:1]1([c:2]2[cH:3][cH:4][cH:5][cH:6][cH:7]2)=[N:22][CH2:21][c:17]2[c:16]([cH:20][nH:19][n:18]2)-[c:10]2[c:9]1[cH:14][c:13]([Cl:15])[cH:12][cH:11]2Participants
3
Sources & evidence
- ORD record
- ord-fc5796bffa7a4099abc166078c5ed2cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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