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Sodium Ion → benzoic acid N'-[2-(5-fluoro-2'-nitro-biphenyl-2-yloxy)-acetyl]-N'-isopropyl-hydrazide

HRID 165850
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HRID 165850 반응식
[Br:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[N:8]([NH:9][C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)=[O:17])[CH:18]([CH3:19])[CH3:20])[cH:21][cH:22][c:23]([F:25])[cH:24]1.[C:26](=[O:27])([O-:28])[O-:29].[CH3:44][O:45][CH2:46][CH2:47][O:48][CH3:49].[N+:32](=[O:33])([O-:34])[c:35]1[c:36]([B:41]([OH:42])[OH:43])[cH:37][cH:38][cH:39][cH:40]1.[Na+:30].[Na+:31]>>[c:2]1(-[c:36]2[c:35]([N+:32](=[O:33])[O-:34])[cH:40][cH:39][cH:38][cH:37]2)[c:3]([O:4][CH2:5][C:6](=[O:7])[N:8]([NH:9][C:10]([c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)=[O:17])[CH:18]([CH3:19])[CH3:20])[cH:21][cH:22][c:23]([F:25])[cH:24]1
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반응물 5

HCID 923Sodium Ion2회HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 2773548(2-Nitrophenyl)boronic acidHCID 58689907benzoic acid N'-[2-(2-bromo-4-fluoro-phenoxy)-acetyl]-N'-isopropyl-hydrazide

생성물 1

HCID 11546901benzoic acid N'-[2-(5-fluoro-2'-nitro-biphenyl-2-yloxy)-acetyl]-N'-isopropyl-hydrazide

출처 및 근거

ORD 기록
ord-d9cf79521ab2486383db3becbe91fae1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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