HRID668195

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7477

Benzoyl chloride, 4-methoxy-

C8H7ClO2

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

结构：Cc1c(C)c2c(c(C)c1N)C(c1ccc(C(C)C)cc1)C(C)(C)O2

HCID10519978

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)Nc2c(C)c(C)c3c(c2C)C(c2ccc(C(C)C)cc2)C(C)(C)O3)cc1

HCID10139269

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dee0dac8454c464fac4ebc1cfa7c8869
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:42]([O:43][CH2:44][CH3:45])(=[O:46])[CH3:47].[CH3:25][O:26][c:27]1[cH:28][cH:29][c:30]([C:31](=[O:32])[Cl:33])[cH:34][cH:35]1.[CH3:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[C:11]([CH3:23])([CH3:24])[O:12][c:13]3[c:14]2[c:15]([CH3:22])[c:16]([NH2:21])[c:17]([CH3:20])[c:18]3[CH3:19])[cH:8][cH:9]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([CH:10]2[C:11]([CH3:23])([CH3:24])[O:12][c:13]3[c:14]2[c:15]([CH3:22])[c:16]([NH:21][C:31]([c:30]2[cH:29][cH:28][c:27]([O:26][CH3:25])[cH:35][cH:34]2)=[O:32])[c:17]([CH3:20])[c:18]3[CH3:19])[cH:8][cH:9]1