HRID2132041

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID81988

N-(3-(Dimethylamino)phenyl)acetamide

C10H14N2O

结构：CN(C)c1ccc(C(=O)c2ccccc2C(=O)O)c(N(C)C)c1

HCID20287212

2-[2,4-Bis(dimethylamino)benzoyl]benzoic acid

C18H20N2O3

PRODUCTS

生成物

结构：CC(=O)Nc1cc(N(C)C)ccc1C1(c2ccc(N(C)C)cc2N(C)C)OC(=O)c2ccccc21

HCID23343375

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ec2c7023824141eb9d12ea65b0529994
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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