HRID682911

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6422

未命名化合物

HCID12052

Silane, triethyl-

C6H16Si

结构：CCOC(=O)C(C)(C)Oc1ccc(OCCC2CN(Cc3ccc(OC)cc3)C(=O)N2C)cc1

HCID57718899

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C(C)(C)Oc1ccc(OCCC2CNC(=O)N2C)cc1

HCID57719191

2-Methyl-2-{4-[2-(3-methyl-2-oxo-imidazolidin-4-yl)-ethoxy]-phenoxy}-propionic acid ethyl ester

C18H26N2O5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-299f94b8d74a495d8456f12b201c20ef
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[cH:10][cH:11][c:12]([O:15][CH2:16][CH2:17][CH:18]2[N:19]([CH3:33])[C:20](=[O:32])[N:21]([CH2:23][c:24]3[cH:25][cH:26][c:27]([O:28][CH3:29])[cH:30][cH:31]3)[CH2:22]2)[cH:13][cH:14]1)=[O:34].[CH2:35]([SiH:36]([CH2:37][CH3:38])[CH2:39][CH3:40])[CH3:41].[OH2:49].[OH:42][C:43]([C:44]([F:45])([F:46])[F:47])=[O:48]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[cH:10][cH:11][c:12]([O:15][CH2:16][CH2:17][CH:18]2[N:19]([CH3:33])[C:20](=[O:32])[NH:21][CH2:22]2)[cH:13][cH:14]1)=[O:34]