HRID2315448

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID6212

Chloroform

CHCl3

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID67982

4-Fluoro-2-methylaniline

C7H8FN

HCID94429

Triphosgene

C3Cl6O3

HCID21890421

4-[(6,7-Dimethoxyquinolin-4-yl)oxy]-2,5-dimethylaniline

C19H20N2O3

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3cc(C)c(NC(=O)Nc4ccc(F)cc4C)cc3C)c2cc1OC

HCID22667099

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f0c419a2b964432b86989cba562c1ab2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([CH3:24])[c:19]([NH2:20])[cH:21][c:22]3[CH3:23])[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:55][CH2:56][N:57]([CH2:58][CH3:59])[CH2:60][CH3:61].[CH:51]([Cl:52])([Cl:53])[Cl:54].[Cl:25][C:26]([Cl:27])([O:28][C:29]([O:30][C:31]([Cl:32])([Cl:33])[Cl:34])=[O:35])[Cl:36].[Cl:62][CH2:63][Cl:64].[F:37][c:38]1[cH:39][c:40]([CH3:45])[c:41]([NH2:42])[cH:43][cH:44]1.[Na+:46].[OH:47][C:48](=[O:49])[O-:50]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][c:18]([CH3:24])[c:19]([NH:20][C:29](=[O:35])[NH:42][c:41]4[c:40]([CH3:45])[cH:39][c:38]([F:37])[cH:44][cH:43]4)[cH:21][c:22]3[CH3:23])[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]