Sodium Ion → 3-acetyl-2-methyl-1H-indole-5-carbonitrile
반응식
[CH3:18][C:19]([Cl:20])=[O:21].[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([C:11]#[N:12])[cH:8][c:9]2[cH:10]1.[Cl:24][CH2:25][Cl:26].[Na+:23].[OH-:22].[Sn:13]([Cl:14])([Cl:15])([Cl:16])[Cl:17]>>[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([C:11]#[N:12])[cH:8][c:9]2[c:10]1[C:19]([CH3:18])=[O:21]참가 물질
7
출처 및 근거
- ORD 기록
- ord-7b02c9056c4f42219cacc8b67d653a90
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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