HRID190543

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID5142464

Methyl 4-phenyl-1H-pyrrole-3-carboxylate

C12H11NO2

HCID23024910

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1cn(Cc2ccc3cc(OCc4ccccc4)ccc3c2)cc1-c1ccccc1

HCID23024964

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5ba3b7f6d5674437a20526726756070a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[O:25][c:26]1[cH:27][c:28]2[cH:29][cH:30][c:31]([CH2:36][Cl:37])[cH:32][c:33]2[cH:34][cH:35]1.[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[H-:1].[Na+:2].[OH2:43].[c:3]1(-[c:9]2[c:10]([C:14](=[O:15])[O:16][CH3:17])[cH:11][nH:12][cH:13]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1>>[c:3]1(-[c:9]2[c:10]([C:14](=[O:15])[O:16][CH3:17])[cH:11][n:12]([CH2:36][c:31]3[cH:30][cH:29][c:28]4[cH:27][c:26]([O:25][CH2:18][c:19]5[cH:20][cH:21][cH:22][cH:23][cH:24]5)[cH:35][cH:34][c:33]4[cH:32]3)[cH:13]2)[cH:4][cH:5][cH:6][cH:7][cH:8]1