HRID160673

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID1140

Toluene

C7H8

HCID8471

Triethylamine

C6H15N

HCID94429

Triphosgene

C3Cl6O3

HCID2735655

4-tert-Butylbenzylamine

C11H17N

HCID11594543

4-(6,7-DIMETHOXY-QUINOLIN-4-YLOXY)-PHENYLAMINE

C17H16N2O3

PRODUCTS

生成物

结构：COc1cc2nccc(Oc3ccc(NC(=O)NCc4ccc(C(C)(C)C)cc4)cc3)c2cc1OC

HCID22132743

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-88f5977017b548f0a57e51d507cc6c51
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:35]([CH3:36])([CH3:37])([CH3:38])[c:39]1[cH:40][cH:41][c:42]([CH2:45][NH2:46])[cH:43][cH:44]1.[C:47](=[O:48])([O-:49])[OH:50].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][cH:18][c:19]([NH2:22])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[CH3:59][CH2:60][N:61]([CH2:62][CH3:63])[CH2:64][CH3:65].[Cl:23][C:24]([Cl:25])([O:26][C:27]([O:28][C:29]([Cl:30])([Cl:31])[Cl:32])=[O:33])[Cl:34].[Na+:51]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][cH:18][c:19]([NH:22][C:27](=[O:33])[NH:46][CH2:45][c:42]4[cH:41][cH:40][c:39]([C:35]([CH3:36])([CH3:37])[CH3:38])[cH:44][cH:43]4)[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]