Ethyl Acetate → 2-[[2-[(2,6-Dichlorobenzoyl)oxymethyl]-1,1,3-trioxo-4-propan-2-yl-1,2-benzothiazol-6-yl]oxy]acetic acid
반응식
[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][N:8]2[S:9](=[O:10])(=[O:11])[c:12]3[cH:13][c:14]([O:23][CH2:24][C:25](=[O:26])[O:27][CH2:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[cH:15][c:16]([CH:20]([CH3:21])[CH3:22])[c:17]3[C:18]2=[O:19])[c:35]([Cl:39])[cH:36][cH:37][cH:38]1.[H:40][H:41]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][N:8]2[S:9](=[O:10])(=[O:11])[c:12]3[cH:13][c:14]([O:23][CH2:24][C:25](=[O:26])[OH:27])[cH:15][c:16]([CH:20]([CH3:21])[CH3:22])[c:17]3[C:18]2=[O:19])[c:35]([Cl:39])[cH:36][cH:37][cH:38]1참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-96940df49aab41508f6d2e496629e45d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)