HRID281916

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8082

Piperidine

C5H11N

HCID1512520

3-(5-formyl-2,4-dimethyl-1H-pyrrol-3-yl)propanoic Acid

C10H13NO3

HCID10586070

6-(3-methoxyphenyl)-1,3-dihydroindol-2-one

C15H13NO2

PRODUCTS

生成物

结构：COc1cccc(-c2ccc3c(c2)NC(=O)C3=Cc2[nH]c(C)c(CCC(=O)O)c2C)c1

HCID54475551

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ecfec72f1d1a4e2f9cca7c14e1477e28
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:1](=[O:2])([OH:3])[CH2:4][CH2:5][c:6]1[c:7]([CH3:14])[nH:8][c:9]([CH:12]=[O:13])[c:10]1[CH3:11].[CH2:33]1[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1.[CH3:15][O:16][c:17]1[cH:18][c:19](-[c:23]2[cH:24][cH:25][c:26]3[c:30]([cH:31]2)[NH:29][C:28](=[O:32])[CH2:27]3)[cH:20][cH:21][cH:22]1.[CH3:39][CH2:40][OH:41]>>[C:1](=[O:2])([OH:3])[CH2:4][CH2:5][c:6]1[c:7]([CH3:14])[nH:8][c:9]([CH:12]=[C:27]2[c:26]3[cH:25][cH:24][c:23](-[c:19]4[cH:18][c:17]([O:16][CH3:15])[cH:22][cH:21][cH:20]4)[cH:31][c:30]3[NH:29][C:28]2=[O:32])[c:10]1[CH3:11]