Potassium Cation → Methyl 2-ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2-methoxyphenyl]propanoate

HRID 154999

반응식

HRID 154999 반응식
[C:35](=[O:36])([O-:37])[O-:38].[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([O:13][CH3:14])[cH:8][c:9]([OH:12])[cH:10][cH:11]1)[O:15][CH2:16][CH3:17])=[O:18].[Cl:19][CH2:20][c:21]1[n:22][c:23](-[c:27]2[cH:28][c:29]([CH3:34])[c:30]([F:33])[cH:31][cH:32]2)[o:24][c:25]1[CH3:26].[Cs+:39].[Cs+:40].[I-:42].[K+:41]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([O:13][CH3:14])[cH:8][c:9]([O:12][CH2:20][c:21]2[n:22][c:23](-[c:27]3[cH:28][c:29]([CH3:34])[c:30]([F:33])[cH:31][cH:32]3)[o:24][c:25]2[CH3:26])[cH:10][cH:11]1)[O:15][CH2:16][CH3:17])=[O:18]

참가 물질

7

반응물 6

HCID 813Potassium CationHCID 19660Carbonate IonHCID 30165Iodide IonHCID 104967Cesium cation2회HCID 219742594-Chloromethyl-2-(4-fluoro-3-methyl-phenyl)-5-methyl-oxazoleHCID 69309092Methyl 2-ethoxy-3-(4-hydroxy-2-methoxyphenyl)propanoate

생성물 1

HCID 69279881Methyl 2-ethoxy-3-[4-[[2-(4-fluoro-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]-2-methoxyphenyl]propanoate

출처 및 근거

ORD 기록
ord-d9ced7544fa54104b6e101c9938f4c8f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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