Benzene → Benzamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-8-yl)-3,4,5-trimethoxy-
반응식
[C:38](=[O:39])([OH:40])[O-:41].[CH2:58]1[c:59]2[c:60]([cH:61][cH:62][cH:63][cH:64]2)[CH2:65][CH2:66][NH:67]1.[CH3:43][O:44][c:45]1[cH:46][c:47]([C:48](=[O:49])[Cl:50])[cH:51][c:52]([O:56][CH3:57])[c:53]1[O:54][CH3:55].[K+:42].[N+:24]([c:25]1[cH:26][cH:27][cH:28][c:29]2[c:30]1[cH:31][n+:32]([CH3:33])[cH:34][cH:35]2)([O-:36])=[O:37].[NH2:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:11]1[CH2:10][N:9]([CH3:12])[CH2:8][CH2:7]2.[Na+:74].[Na+:75].[O-:76][C:77](=[O:78])[O-:79].[c:13]1([CH3:14])[cH:15][cH:16][c:17]([S:18]([O-:19])(=[O:20])=[O:21])[cH:22][cH:23]1.[cH:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1>>[NH:1]([c:2]1[cH:3][cH:4][cH:5][c:6]2[c:11]1[CH2:10][N:9]([CH3:12])[CH2:8][CH2:7]2)[C:48]([c:47]1[cH:46][c:45]([O:44][CH3:43])[c:53]([O:54][CH3:55])[c:52]([O:56][CH3:57])[cH:51]1)=[O:49]참가 물질
11
반응물 10
생성물 1
출처 및 근거
- ORD 기록
- ord-b193dff65a924eb2a57c9a60ebefd272
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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