HRID179938

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID7918

Acetic anhydride

C4H6O3

结构：Cc1c2n(c3ccccc13)C(=O)C(C(O)c1cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)c(C)n1)CC2

HCID15051937

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OC(c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c(C)n1)C1CCc2c(C)c3ccccc3n2C1=O

HCID15051939

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e9803e51cfd54607b8b3654372499a19
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

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