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Potassium Cation → 6-fluoro-3-{2-[4-(4-chloro-3-methoxy-phenyl)-piperazin-1-yl]-2-oxo-ethyl}-3H-benzooxazol-2-one

HRID 205042
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반응식

HRID 205042 반응식
[CH3:37][N:38]1[CH2:39][CH2:40][CH2:41][C:42]1=[O:43].[Cl:1][CH2:2][C:3](=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([c:11]2[cH:12][c:13]([O:18][CH3:19])[c:14]([Cl:17])[cH:15][cH:16]2)[CH2:9][CH2:10]1.[F:20][c:21]1[cH:22][c:23]2[c:24]([nH:25][c:26](=[O:28])[o:27]2)[cH:29][cH:30]1.[K+:31].[K+:32].[O-:33][C:34]([O-:35])=[O:36]>>[CH2:2]([C:3](=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([c:11]2[cH:12][c:13]([O:18][CH3:19])[c:14]([Cl:17])[cH:15][cH:16]2)[CH2:9][CH2:10]1)[n:25]1[c:24]2[c:23]([cH:22][c:21]([F:20])[cH:30][cH:29]2)[o:27][c:26]1=[O:28]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium Cation2회HCID 13387N-methyl-2-pyrrolidoneHCID 19660Carbonate IonHCID 144573586-Fluoro-1,3-benzoxazol-2(3H)-oneHCID 210711262-Chloro-1-(4-(4-chloro-3-methoxyphenyl)piperazin-1-yl)ethanone

생성물 1

HCID 160594436-fluoro-3-{2-[4-(4-chloro-3-methoxy-phenyl)-piperazin-1-yl]-2-oxo-ethyl}-3H-benzooxazol-2-one
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출처 및 근거

ORD 기록
ord-3f714866c64145bcb2dd500c1454a47d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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