Isobutanol → isobutyl 5,7-dihydro-6H-dibenz[c,e]azepine-6-carboximidate
반응식
[CH3:18][CH:19]([CH3:20])[CH2:21][OH:22].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[CH2:8][N:7]([C:16]#[N:17])[CH2:6]2>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[CH2:8][N:7]([C:16](=[NH:17])[O:22][CH2:21][CH:19]([CH3:18])[CH3:20])[CH2:6]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-3cfbb277616c4b8d8a1ccf98f5a946af
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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