HRID1210522

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID1049

Pyridine

C5H5N

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID88969

Benzoyl chloride, 2-methoxy-

C8H7ClO2

HCID21939722

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1C(=O)Nc1ccc(COc2ccc3c(c2)CCC(CN(C)C)C3)cc1

HCID21063037

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6bb6460484c741cba13988b48b62ad4f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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