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Potassium Cation → [3-[7-chloro-4-[(2,2,2-trifluoroethylamino)methyl]-1H-indazol-5-yl]-1-methoxy-1-oxopropan-2-yl] benzoate

HRID 2147391
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HRID 2147391 반응식
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]([C:11](=[O:12])[O:13][CH3:14])[CH2:15][c:16]1[c:17]([CH2:26][Cl:27])[c:18]2[cH:19][n:20][nH:21][c:22]2[c:23]([Cl:25])[cH:24]1.[C:37](=[O:38])([O-:39])[O-:40].[CH3:28][C:29]#[N:30].[CH3:43][OH:44].[F:31][C:32]([CH2:33][NH2:34])([F:35])[F:36].[K+:41].[K+:42]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH:10]([C:11](=[O:12])[O:13][CH3:14])[CH2:15][c:16]1[c:17]([CH2:26][NH:34][CH2:33][C:32]([F:31])([F:35])[F:36])[c:18]2[cH:19][n:20][nH:21][c:22]2[c:23]([Cl:25])[cH:24]1
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반응물 6

HCID 813Potassium Cation2회HCID 887MethanolHCID 6342AcetonitrileHCID 9773Ethanamine, 2,2,2-trifluoro-HCID 19660Carbonate IonHCID 67316783[3-[7-chloro-4-(chloromethyl)-1H-indazol-5-yl]-1-methoxy-1-oxopropan-2-yl] benzoate

생성물 1

HCID 67317561
[3-[7-chloro-4-[(2,2,2-trifluoroethylamino)methyl]-1H-indazol-5-yl]-1-methoxy-1-oxopropan-2-yl] benzoate

출처 및 근거

ORD 기록
ord-84788c7bb76b409c9a7a4d638585375d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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