Ethyl Acetate → HCID 178469070, compound

HRID 214233Notes

Reaction equation

HRID 214233 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH2:28]([CH3:29])[O:30][C:31]([c:32]1[cH:33][c:34]([F:39])[c:35]([F:38])[cH:36][cH:37]1)=[O:40].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[CH3:47][C:48]([N:49]([CH3:50])[CH3:51])=[O:52].[Cs+:5].[Cs+:6].[OH:7][c:8]1[cH:9][c:10]([C:11](=[O:12])[NH:13][c:14]2[n:15][n:16]([CH3:19])[cH:17][cH:18]2)[cH:20][c:21]([O:23][CH:24]([CH2:25][OH:26])[CH3:27])[cH:22]1>>[O:7]([c:8]1[cH:9][c:10]([C:11](=[O:12])[NH:13][c:14]2[n:15][n:16]([CH3:19])[cH:17][cH:18]2)[cH:20][c:21]([O:23][CH:24]([CH2:25][OH:26])[CH3:27])[cH:22]1)[c:35]1[c:34]([F:39])[cH:33][c:32]([C:31]([O:30][CH2:28][CH3:29])=[O:40])[cH:37][cH:36]1

Participants

7

Reactant 6

HCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 104967Cesium cation2×HCID 2737171Ethyl 3,4-difluorobenzoateHCID 722605813-hydroxy-5-(1-hydroxypropan-2-yloxy)-N-(1-methylpyrazol-3-yl)benzamide

Product 1

HCID 178469070HCID 178469070, compound

Sources & evidence

ORD record
ord-2ea55bba04254afe8192391c321dedd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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