Water → 5-Cyano-2,3-dihydro-3,3-dimethyl-2-ethoxybenzofuran
반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:15]1)[C:7]([CH3:13])([CH3:14])[CH:8]([O:10][CH2:11][CH3:12])[O:9]2.[C-:16]#[N:17].[Na:18][C:19]#[N:20].[O:21]=[CH:22][N:23]([CH3:24])[CH3:25].[OH2:26]>>[c:2]1([C:19]#[N:20])[cH:3][cH:4][c:5]2[c:6]([cH:15]1)[C:7]([CH3:13])([CH3:14])[CH:8]([O:10][CH2:11][CH3:12])[O:9]2참가 물질
6
출처 및 근거
- ORD 기록
- ord-fb6a2408afac491e97e48fc76633cdcf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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