Acetic Acid → Ro 14-7437

HRID 1123725Notes

Reaction equation

HRID 1123725 reaction equation
[CH3:23][I:24].[CH3:26][N:27]([CH3:28])[CH:29]=[O:30].[CH3:31][C:32](=[O:33])[OH:34].[H-:1].[Na+:2].[O:3]=[C:4]1[NH:5][CH2:6][c:7]2[n:8]([cH:15][n:16][c:17]2[C:18](=[O:19])[O:20][CH2:21][CH3:22])-[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2.[OH2:25]>>[O:3]=[C:4]1[N:5]([CH3:23])[CH2:6][c:7]2[n:8]([cH:15][n:16][c:17]2[C:18](=[O:19])[O:20][CH2:21][CH3:22])-[c:9]2[c:10]1[cH:11][cH:12][cH:13][cH:14]2

Participants

8

Sources & evidence

ORD record
ord-d51fd2f6a9f742fba1521488df8cbcb9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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