HRID806954

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID12500430

未命名化合物

HCID22035615

未命名化合物

结构：CC(C)(C)CCC(Oc1ccc(C(=O)O)cc1)c1ccc(-c2ccc(C(F)(F)F)cc2)nc1

HCID67342945

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CC(C)NC(=O)c1ccc(OC(CCC(C)(C)C)c2ccc(-c3ccc(C(F)(F)F)cc3)nc2)cc1

HCID67343031

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5bf75783c9d445cab1a935ae6f933338
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:1][C:2]([CH2:3][CH2:4][CH:5]([O:6][c:7]1[cH:8][cH:9][c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15]1)[c:16]1[cH:17][n:18][c:19](-[c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)[cH:20][cH:21]1)([CH3:32])[CH3:33].[CH3:45][N:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1.[CH3:52][O:53][C:54]([CH2:55][CH:56]([CH3:57])[NH2:58])=[O:59].[Cl:34][c:35]1[n:36][n:37][n:38][c:39]([O:40][CH3:41])[c:42]1[O:43][CH3:44].[Cl:60][CH2:61][Cl:62].[OH2:63]>>[CH3:1][C:2]([CH2:3][CH2:4][CH:5]([O:6][c:7]1[cH:8][cH:9][c:10]([C:11](=[O:12])[NH:58][CH:56]([CH2:55][C:54]([O:53][CH3:52])=[O:59])[CH3:57])[cH:14][cH:15]1)[c:16]1[cH:17][n:18][c:19](-[c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)[cH:20][cH:21]1)([CH3:32])[CH3:33]