HRID306619

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7914

Isopropyl ether

C6H14O

HCID8857

Ethyl acetate

C4H8O2

HCID66960

Dimethylaminopropyl chloride

C5H12ClN

HCID166653

Hydride

H-

结构：COc1ccc2[nH]c3c4[nH]c5ccc(OC)cc5c4c4c(c3c2c1)C(=O)N(C)C4=O

HCID21216832

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2[nH]c3c(c4c(c5c6cc(OC)ccc6n(CCCN(C)C)c35)C(=O)N(C)C4=O)c2c1

HCID21216884

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-62e8812133ce401eb310bdfa2741c3bd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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