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Sodium Ion → tert-butyl 6-methoxy-8-[(2-methoxy-5-methylphenyl)sulfonyl]-1-methyl-1,3,4,8-tetrahydro-2H-[1,4]oxazepino[6,7-e]indole-2-carboxylate

HRID 136816
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HRID 136816 반응식
[CH3:1][O:2][c:3]1[c:4]2[c:5]([c:6]3[cH:7][cH:8][nH:9][c:10]3[cH:11]1)[CH:12]([CH3:24])[N:13]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:14][CH2:15][O:16]2.[CH3:27][O:28][c:29]1[c:30]([S:36](=[O:37])(=[O:38])[Cl:39])[cH:31][c:32]([CH3:35])[cH:33][cH:34]1.[H-:25].[Na+:26].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[OH2:40]>>[CH3:1][O:2][c:3]1[c:4]2[c:5]([c:6]3[cH:7][cH:8][n:9]([S:36]([c:30]4[c:29]([O:28][CH3:27])[cH:34][cH:33][c:32]([CH3:35])[cH:31]4)(=[O:37])=[O:38])[c:10]3[cH:11]1)[CH:12]([CH3:24])[N:13]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:14][CH2:15][O:16]2
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참가 물질

7

반응물 6

HCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 1451496-Methoxy-m-toluenesulfonyl chlorideHCID 166653HydrideHCID 69096461tert-Butyl 6-methoxy-1-methyl-1,3,4,8-tetrahydro-2H-[1,4]oxazepino[6,7-e]indole-2-carboxylate

생성물 1

HCID 67242131
tert-butyl 6-methoxy-8-[(2-methoxy-5-methylphenyl)sulfonyl]-1-methyl-1,3,4,8-tetrahydro-2H-[1,4]oxazepino[6,7-e]indole-2-carboxylate

출처 및 근거

ORD 기록
ord-8d6caa63432a490f960f1f2ba4865211
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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