HRID283529

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID70042

3-Benzyloxybenzyl alcohol

C14H13ClO

HCID74845

2-Cyano-3-phenylacrylic acid ethyl ester

C12H11NO2

PRODUCTS

生成物

结构：CCOC(=O)C(C#N)C(Cc1ccc(OCc2ccccc2)cc1)c1ccccc1

HCID18772157

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ef5c0b9083ce4ddeb7d134f3a6cb6228
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

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