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Dimethylformamide → [9-(6-Fluoro-pyridin-2-ylmethyl)-6-trifluoromethoxy-2,3,4,9-tetrahydro-1H-carbazol-3-yl]-carbamic acid benzyl ester

HRID 143049
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HRID 143049 반응식
[Br:36][CH2:37][c:38]1[n:39][c:40]([F:44])[cH:41][cH:42][cH:43]1.[C:1](=[O:2])([O-:3])[O-:4].[CH2:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[O:14][C:15]([NH:16][CH:17]1[CH2:18][CH2:19][c:20]2[nH:21][c:22]3[cH:23][cH:24][c:25]([O:30][C:31]([F:32])([F:33])[F:34])[cH:26][c:27]3[c:28]2[CH2:29]1)=[O:35].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[Cs+:5].[Cs+:6].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49]>>[CH2:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[O:14][C:15]([NH:16][CH:17]1[CH2:18][CH2:19][c:20]2[n:21]([CH2:37][c:38]3[n:39][c:40]([F:44])[cH:41][cH:42][cH:43]3)[c:22]3[cH:23][cH:24][c:25]([O:30][C:31]([F:32])([F:33])[F:34])[cH:26][c:27]3[c:28]2[CH2:29]1)=[O:35]
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반응물 6

HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 139852182-(Bromomethyl)-6-fluoropyridineHCID 57431664(6-trifluoromethoxy-2,3,4,9-tetrahydro-1H-carbazol-3-yl)-carbamic acid benzyl ester

생성물 1

HCID 59161299
[9-(6-Fluoro-pyridin-2-ylmethyl)-6-trifluoromethoxy-2,3,4,9-tetrahydro-1H-carbazol-3-yl]-carbamic acid benzyl ester

출처 및 근거

ORD 기록
ord-b6178c05ff4d4d3cac8c64bb68766525
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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