HRID207602

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID23294433

未命名化合物

结构：CC(=O)NCCc1ccc(F)cc1OCCOC1CN(C(=O)OC(C)(C)C)CCC1c1ccc(O)cc1

HCID68504580

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NCCc1ccc(F)cc1OCCOC1CN(C(=O)OC(C)(C)C)CCC1c1ccc(OCCCOc2cccc(F)c2)cc1

HCID68505109

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0df8cef96f994452b348a9e7712ba98b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:38][CH2:39][CH2:40][CH2:41][O:42][c:43]1[cH:44][c:45]([F:49])[cH:46][cH:47][cH:48]1.[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH2:6][c:7]1[c:8]([O:9][CH2:10][CH2:11][O:12][CH:13]2[CH2:14][N:15]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:16][CH2:17][CH:18]2[c:19]2[cH:20][cH:21][c:22]([OH:25])[cH:23][cH:24]2)[cH:33][c:34]([F:37])[cH:35][cH:36]1>>[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH2:6][c:7]1[c:8]([O:9][CH2:10][CH2:11][O:12][CH:13]2[CH2:14][N:15]([C:26](=[O:27])[O:28][C:29]([CH3:30])([CH3:31])[CH3:32])[CH2:16][CH2:17][CH:18]2[c:19]2[cH:20][cH:21][c:22]([O:25][CH2:39][CH2:40][CH2:41][O:42][c:43]3[cH:44][c:45]([F:49])[cH:46][cH:47][cH:48]3)[cH:23][cH:24]2)[cH:33][c:34]([F:37])[cH:35][cH:36]1