Acetic Acid → HCID 178502837, compound

HRID 2139867Notes

Reaction equation

HRID 2139867 reaction equation
[CH3:25][C:26](=[O:27])[OH:28].[CH3:29][CH2:30][O:31][C:32](=[O:33])[CH3:34].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][c:8]2[c:9]([C:14]([C:15](=[O:16])[NH2:17])=[N:18][O:19][CH3:20])[cH:10][cH:11][cH:12][cH:13]2)[cH:21][cH:22]1.[NH2:23][OH:24]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][c:8]2[c:9]([C:14]([C:15](=[O:16])[N:17]=[CH:25][NH:23][OH:24])=[N:18][O:19][CH3:20])[cH:10][cH:11][cH:12][cH:13]2)[cH:21][cH:22]1

Participants

5

Sources & evidence

ORD record
ord-a4284d3731fe4d8c8065f15a2ac9d1f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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