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Acetic Acid → 5-(3-Chlorophenyl)-6-(5-chloro-2-pyridinyl)-1-[(2,4-dimethoxyphenyl)methyl]piperidin-2-one

HRID 2149437
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인쇄 미리보기

반응식

HRID 2149437 반응식
[CH3:36][C:37](=[O:38])[OH:39].[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][CH2:10][C:11](=[O:21])[NH:12][CH:13]2[c:14]2[n:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1.[Cl:24][CH2:25][c:26]1[c:27]([O:34][CH3:35])[cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]1.[H-:22].[Na+:23].[Na+:44].[O-:40][C:41]([OH:42])=[O:43].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49]>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][CH2:10][C:11](=[O:21])[N:12]([CH2:25][c:26]3[c:27]([O:34][CH3:35])[cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]3)[CH:13]2[c:14]2[n:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:5][cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 6228DimethylformamideHCID 166653HydrideHCID 185052611-(Chloromethyl)-2,4-dimethoxybenzeneHCID 679993315-(3-Chlorophenyl)-6-(5-chloro-2-pyridinyl)piperidin-2-one

생성물

1
HCID 768347485-(3-Chlorophenyl)-6-(5-chloro-2-pyridinyl)-1-[(2,4-dimethoxyphenyl)methyl]piperidin-2-one

출처 및 근거

ORD 기록
ord-e4e7acaf48334aa5b2a9349c8381c0c7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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