Acetic Acid → HCID 178498107, compound

HRID 177847Notes

Reaction equation

HRID 177847 reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7](-[n:10]2[n:11][c:12]3[c:21]4[c:16]([nH:15][c:14](-[c:22]5[cH:23][cH:24][c:25]([N+:28]([O-:29])=[O:30])[cH:26][cH:27]5)[c:13]-3[c:31]2=[O:32])[cH:17][cH:18][cH:19][cH:20]4)[cH:8][cH:9]1)=[O:33].[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][CH2:39][OH:40].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7](-[n:10]2[n:11][c:12]3[c:21]4[c:16]([nH:15][c:14](-[c:22]5[cH:23][cH:24][c:25]([NH2:28])[cH:26][cH:27]5)[c:13]-3[c:31]2=[O:32])[cH:17][cH:18][cH:19][cH:20]4)[cH:8][cH:9]1)=[O:33]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 6228DimethylformamideHCID 178498108HCID 178498108, compound

Product 1

HCID 178498107HCID 178498107, compound

Sources & evidence

ORD record
ord-941da0f17b6d498299e64f27ac8bfab2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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