Acetic Acid → HCID 68858747, compound

HRID 164161Notes

Reaction equation

HRID 164161 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([NH2:23])[s:8][cH:9][c:10]1[CH:11]=[CH:12][c:13]1[c:14]([Cl:22])[cH:15][c:16]([CH:19]([CH3:20])[CH3:21])[cH:17][cH:18]1.[CH3:35][C:36](=[O:37])[OH:38].[O:24]=[C:25]1[O:26][C:27](=[O:28])[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]21>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([N:23]2[C:25](=[O:24])[c:34]3[c:29]([cH:30][cH:31][cH:32][cH:33]3)[C:27]2=[O:26])[s:8][cH:9][c:10]1[CH:11]=[CH:12][c:13]1[c:14]([Cl:22])[cH:15][c:16]([CH:19]([CH3:20])[CH3:21])[cH:17][cH:18]1

Participants

4

Sources & evidence

ORD record
ord-e1d2ef9819f1452ba7890162230da2b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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