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Dimethylformamide → Methyl 7-[4-({[3-(2,6-dichlorophenyl)-5-(1-methylethyl)-4-isoxazolyl]methyl}oxy)phenyl]-1-naphthalenecarboxylate

HRID 2156135
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HRID 2156135 반응식
[C:40](=[O:41])([O-:42])[O-:43].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Cl:1][CH2:2][c:3]1[c:4](-[c:11]2[c:12]([Cl:18])[cH:13][cH:14][cH:15][c:16]2[Cl:17])[n:5][o:6][c:7]1[CH:8]([CH3:9])[CH3:10].[Cs+:44].[Cs+:45].[OH:19][c:20]1[cH:21][cH:22][c:23](-[c:26]2[cH:27][cH:28][c:29]3[cH:30][cH:31][cH:32][c:33]([C:36](=[O:37])[O:38][CH3:39])[c:34]3[cH:35]2)[cH:24][cH:25]1>>[CH2:2]([c:3]1[c:4](-[c:11]2[c:12]([Cl:18])[cH:13][cH:14][cH:15][c:16]2[Cl:17])[n:5][o:6][c:7]1[CH:8]([CH3:9])[CH3:10])[O:19][c:20]1[cH:21][cH:22][c:23](-[c:26]2[cH:27][cH:28][c:29]3[cH:30][cH:31][cH:32][c:33]([C:36](=[O:37])[O:38][CH3:39])[c:34]3[cH:35]2)[cH:24][cH:25]1
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반응물 5

HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 59264859Methyl 7-(4-hydroxyphenyl)-1-naphthalenecarboxylateHCID 592648754-(Chloromethyl)-3-(2,6-dichlorophenyl)-5-isopropylisoxazole

생성물 1

HCID 59264858
Methyl 7-[4-({[3-(2,6-dichlorophenyl)-5-(1-methylethyl)-4-isoxazolyl]methyl}oxy)phenyl]-1-naphthalenecarboxylate

출처 및 근거

ORD 기록
ord-aa318efa0a714591aa1c78554aab57f2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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