1,2-Dichloroethane → Butyl 1-{(trans-4-tert-butylcyclohexyl)[(4-isopropylphenyl)acetyl]amino}indane-5-carboxylate
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][CH:8]([NH:11][CH:12]2[CH2:13][CH2:14][c:15]3[cH:16][c:17]([C:21](=[O:22])[O:23][CH2:24][CH2:25][CH2:26][CH3:27])[cH:18][cH:19][c:20]32)[CH2:9][CH2:10]1.[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH:28]([CH3:29])([CH3:30])[c:31]1[cH:32][cH:33][c:34]([CH2:37][C:38](=[O:39])[OH:40])[cH:35][cH:36]1.[CH:55]([N:56]([CH2:57][CH3:58])[CH:59]([CH3:60])[CH3:61])([CH3:62])[CH3:63].[Na+:68].[O-:64][C:65]([OH:66])=[O:67].[OH:45][n:46]1[c:47]2[c:48]([cH:49][cH:50][cH:51][cH:52]2)[n:53][n:54]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][CH:8]([N:11]([CH:12]2[CH2:13][CH2:14][c:15]3[cH:16][c:17]([C:21](=[O:22])[O:23][CH2:24][CH2:25][CH2:26][CH3:27])[cH:18][cH:19][c:20]32)[C:38]([CH2:37][c:34]2[cH:33][cH:32][c:31]([CH:28]([CH3:29])[CH3:30])[cH:36][cH:35]2)=[O:39])[CH2:9][CH2:10]1참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-0ef9a030234443d3bc69f0b50a768082
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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