Ethanol → HCID 67049539, compound

HRID 287783Notes

Reaction equation

HRID 287783 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[cH:11][cH:12][c:13]([C:16]([CH3:17])=[O:18])[cH:14][cH:15]2)[CH2:8][CH2:9]1.[CH3:34][CH2:35][OH:36].[CH:19](=[O:20])[c:21]1[cH:22][cH:23][c:24]([CH:25]=[CH:26][C:27](=[O:28])[OH:29])[cH:30][cH:31]1.[K+:33].[OH-:32].[OH2:37]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[cH:11][cH:12][c:13]([C:16]([CH:17]=[CH:19][c:21]3[cH:22][cH:23][c:24]([CH:25]=[CH:26][C:27](=[O:28])[OH:29])[cH:30][cH:31]3)=[O:18])[cH:14][cH:15]2)[CH2:8][CH2:9]1

Participants

7

Reactant 6

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 962WaterHCID 980772-Propenoic acid, 3-(4-formylphenyl)-HCID 231182951-[4-(4-Acetylphenyl)piperazin-1-yl]ethan-1-one

Product 1

HCID 67049539HCID 67049539, compound

Sources & evidence

ORD record
ord-864a7eb69ca944ab8dbdad07c99050fb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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