Acetate → Methyl 6-(dibenzylamino)-3-(3-methoxy-3-oxoprop-1-enyl)pyridine-2-carboxylate

HRID 291926Notes

Reaction equation

HRID 291926 reaction equation
[Br:1][c:2]1[c:3]([C:23](=[O:24])[O:25][CH3:26])[n:4][c:5]([N:8]([CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:6][cH:7]1.[C:46]([CH:47]=[CH2:48])(=[O:49])[O:50][CH3:51].[C:62]([O-:63])(=[O:64])[CH3:65].[C:67]([O-:68])(=[O:69])[CH3:70].[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[CH3:57][CH2:58][O:59][CH2:60][CH3:61].[Pd+2:66].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[c:2]1([CH:48]=[CH:47][C:46](=[O:49])[O:50][CH3:51])[c:3]([C:23](=[O:24])[O:25][CH3:26])[n:4][c:5]([N:8]([CH2:9][c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 7294Methyl AcrylateHCID 11776TriphenylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 59145917Methyl 3-bromo-6-(dibenzylamino)pyridine-2-carboxylate

Product 1

HCID 68699373Methyl 6-(dibenzylamino)-3-(3-methoxy-3-oxoprop-1-enyl)pyridine-2-carboxylate

Sources & evidence

ORD record
ord-fc97999c2b79469f86df7dc92f572c1a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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