HRID935691

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID8028

Tetrahydrofuran

C4H8O

HCID14041

Propanedioic acid, 2-(acetylamino)-, 1,3-diethyl ester

C9H15NO5

HCID10545362

1-(2-Iodoethyl)-4-octylbenzene

C16H25I

PRODUCTS

生成物

结构：CCCCCCCCc1ccc(CCC(NC(C)=O)(C(=O)OCC)C(=O)OCC)cc1

HCID9845753

Diethyl acetamido[2-(4-octylphenyl)ethyl]propanedioate

C25H39NO5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5a1505903d5646ef9fa749e69d8e5fab
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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