Acetate → Methyl 2-[(2-methoxyethoxy)methoxy]-3-(5-methoxypyridin-2-ylamino)benzoate

HRID 163114Notes

Reaction equation

HRID 163114 reaction equation
[C:74](=[O:75])([O-:76])[O-:77].[CH2:80]1[O:81][CH2:82][CH2:83][O:84][CH2:85]1.[CH3:1][O:2][C:3]([c:4]1[c:5]([O:11][CH2:12][O:13][CH2:14][CH2:15][O:16][CH3:17])[c:6]([NH2:10])[cH:7][cH:8][cH:9]1)=[O:18].[Cl:19][c:20]1[n:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]1.[Cs+:78].[Cs+:79].[O-:87][C:88]([CH3:89])=[O:90].[O-:91][C:92]([CH3:93])=[O:94].[Pd+2:86].[c:28]1([P:29]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:36]2[cH:37][cH:38][c:39]3[c:40]([cH:41][cH:42][cH:43][cH:44]3)[c:45]2-[c:46]2[c:47]3[c:48]([cH:49][cH:50][cH:51][cH:52]3)[cH:53][cH:54][c:55]2[P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([O:11][CH2:12][O:13][CH2:14][CH2:15][O:16][CH3:17])[c:6]([NH:10][c:20]2[n:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]2)[cH:7][cH:8][cH:9]1)=[O:18]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 151690002-Chloro-5-methoxypyridineHCID 582228163-Amino-2-((2-methoxyethoxy)methoxy)benzoic acid methyl ester

Product 1

HCID 67410020Methyl 2-[(2-methoxyethoxy)methoxy]-3-(5-methoxypyridin-2-ylamino)benzoate

Sources & evidence

ORD record
ord-59aea68b2a364167aa90cafcf6713182
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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