HRID1143609

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID345278

4-(Morpholin-4-yl)benzoic acid

C11H13NO3

结构：Cc1ccc(N)cc1Nc1cc(C(F)(F)F)nc(-c2ccncc2)n1

HCID22732458

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(NC(=O)c2ccc(N3CCOCC3)cc2)cc1Nc1cc(C(F)(F)F)nc(-c2ccncc2)n1

HCID22732451

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6e32435e98d34df29a938dcbb3608420
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH3:25])[c:6]([NH:7][c:8]2[n:9][c:10](-[c:18]3[cH:19][cH:20][n:21][cH:22][cH:23]3)[n:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]2)[cH:24]1.[O:26]1[CH2:27][CH2:28][N:29]([c:32]2[cH:33][cH:34][c:35]([C:36](=[O:37])[OH:38])[cH:39][cH:40]2)[CH2:30][CH2:31]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH3:25])[c:6]([NH:7][c:8]2[n:9][c:10](-[c:18]3[cH:19][cH:20][n:21][cH:22][cH:23]3)[n:11][c:12]([C:14]([F:15])([F:16])[F:17])[cH:13]2)[cH:24]1)[C:36]([c:35]1[cH:34][cH:33][c:32]([N:29]2[CH2:28][CH2:27][O:26][CH2:31][CH2:30]2)[cH:40][cH:39]1)=[O:37]