2,4,6-Trimethylaniline → 2-Methyl-6,11-dihydro-dibenzo[b,e]oxepine-11-carboxylic acid (2,4,6-trimethyl-phenyl)-amide
반응식
[CH3:1][c:2]1[cH:3][c:4]2[c:5]([cH:18][cH:19]1)[O:6][CH2:7][c:8]1[c:9]([cH:14][cH:15][cH:16][cH:17]1)[CH:10]2[C:11](=[O:12])[OH:13].[CH3:20][c:21]1[c:22]([NH2:23])[c:24]([CH3:29])[cH:25][c:26]([CH3:28])[cH:27]1>>[CH3:1][c:2]1[cH:3][c:4]2[c:5]([cH:18][cH:19]1)[O:6][CH2:7][c:8]1[c:9]([cH:14][cH:15][cH:16][cH:17]1)[CH:10]2[C:11](=[O:12])[NH:23][c:22]1[c:21]([CH3:20])[cH:27][c:26]([CH3:28])[cH:25][c:24]1[CH3:29]참가 물질
3
출처 및 근거
- ORD 기록
- ord-ef8a17a8df1546f4a265375f18e628ca
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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