Acetone → 3-cyano-N-[2-(4-fluorophenyl)-4-oxobutyl]-N-methyl-1-naphthamide

HRID 106839Notes

Reaction equation

HRID 106839 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:13](=[O:14])[N:15]([CH3:16])[CH2:17][CH:18]([CH2:19][CH:20]=[CH2:21])[c:22]2[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]2)[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12]1.[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:29][N+:30]1([O-:31])[CH2:32][CH2:34][O:33][CH2:35][CH2:36]1.[CH3:48][C:49](=[O:50])[CH3:51].[CH3:52][C:53]([OH:54])([CH3:55])[CH3:56].[I+3:42]([O-:43])([O-:44])([O-:45])[O-:46].[Na+:41].[Na+:47].[O:63]=[Os:64](=[O:65])(=[O:66])=[O:67].[OH2:57].[S:37](=[O:38])([OH:39])[O-:40]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([C:13](=[O:14])[N:15]([CH3:16])[CH2:17][CH:18]([CH2:19][CH:20]=[O:33])[c:22]2[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]2)[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12]1

Participants

11

Reactant 10

HCID 180AcetoneHCID 923Sodium ion2×HCID 962WaterHCID 6386tert-ButanolHCID 8028TetrahydrofuranHCID 30318Osmium TetroxideHCID 82029Methyl morpholine oxideHCID 104748BisulfiteHCID 167232PeriodateHCID 689791393-cyano-N-[2-(4-fluorophenyl)pent-4-en-1-yl]-N-methyl-1-naphthamide

Product 1

HCID 111530243-cyano-N-[2-(4-fluorophenyl)-4-oxobutyl]-N-methyl-1-naphthamide

Sources & evidence

ORD record
ord-f74b2e8581b442af82035d65aa7defd7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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