HRID288077

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID1140

Toluene

C7H8

HCID6371

Phosgene

CCl2O

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID2736365

ethyl 3-aminoisonicotinate

C8H10N2O2

HCID11379094

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)c1ccncc1NC(=O)OCc1cc2cc(-c3ccccc3)ccc2o1

HCID69562466

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-286ee2d7c0164df5bfc101f140428941
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

[CH2:2]([CH3:3])[O:4][C:5](=[O:6])[c:7]1[c:8]([NH2:13])[cH:9][n:10][cH:11][cH:12]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH3:48][N:49]([c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1)[CH3:56].[Cl:20][C:21]([Cl:22])=[O:23].[ClH:1].[c:24]1(-[c:30]2[cH:31][cH:32][c:33]3[c:34]([cH:35][c:36]([CH2:38][OH:39])[o:37]3)[cH:40]2)[cH:25][cH:26][cH:27][cH:28][cH:29]1.[cH:14]1[cH:15][cH:16][n:17][cH:18][cH:19]1>>[CH2:2]([CH3:3])[O:4][C:5](=[O:6])[c:7]1[c:8]([NH:13][C:21](=[O:23])[O:39][CH2:38][c:36]2[cH:35][c:34]3[c:33]([cH:32][cH:31][c:30](-[c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[cH:40]3)[o:37]2)[cH:9][n:10][cH:11][cH:12]1