Ethyl Acetate → 2-{2,5-Dichloro-4-[3-(4-cyclopropyl-3,4-dihydro-2H-quinoxaline-1-carbonyl)-pyridin-4-yloxy]-phenoxy}-2-methyl-propionic acid ethyl ester

HRID 298534Notes

Reaction equation

HRID 298534 reaction equation
[C:41]([O:42][CH2:43][CH3:44])(=[O:45])[CH3:46].[CH2:32]([CH3:33])[O:34][C:35]([C:36]([CH3:37])([CH3:38])[Br:39])=[O:40].[CH3:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[CH:1]1([N:4]2[CH2:5][CH2:6][N:7]([C:14](=[O:15])[c:16]3[cH:17][n:18][cH:19][cH:20][c:21]3[O:22][c:23]3[c:24]([Cl:31])[cH:25][c:26]([OH:30])[c:27]([Cl:29])[cH:28]3)[c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]32)[CH2:2][CH2:3]1>>[CH:1]1([N:4]2[CH2:5][CH2:6][N:7]([C:14](=[O:15])[c:16]3[cH:17][n:18][cH:19][cH:20][c:21]3[O:22][c:23]3[c:24]([Cl:31])[cH:25][c:26]([O:30][C:36]([C:35]([O:34][CH2:32][CH3:33])=[O:40])([CH3:37])[CH3:38])[c:27]([Cl:29])[cH:28]3)[c:8]3[cH:9][cH:10][cH:11][cH:12][c:13]32)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 8900HeptaneHCID 11745Propanoic acid, 2-bromo-2-methyl-, ethyl esterHCID 53311358(4-Cyclopropyl-3,4-dihydro-2H-quinoxalin-1-yl)-[4-(2,5-dichloro-4-hydroxy-phenoxy)-pyridin-3-yl]-methanone

Product 1

HCID 533113612-{2,5-Dichloro-4-[3-(4-cyclopropyl-3,4-dihydro-2H-quinoxaline-1-carbonyl)-pyridin-4-yloxy]-phenoxy}-2-methyl-propionic acid ethyl ester

Sources & evidence

ORD record
ord-13d697cba19747c984b4e58e50d4c9dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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