HRID123742

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID16259

3-Phenylpropylamine

C9H13N

反应SMILES：CCOC(=O)c1cc(-c2cccc(Cl)c2)c(OCCO)c(-c2cccc(Cl)c2)c1

HCID53990642

未命名化合物

HCID178418339

Butyllithium

C4H9Li

PRODUCTS

产物

反应SMILES：O=C(NCCCc1ccccc1)c1cc(-c2cccc(Cl)c2)c(OCCO)c(-c2cccc(Cl)c2)c1

HCID22237459

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-bcea0c66f4d6486fb12955d887c7d60c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[CH2:16]([O:18][C:19](=[O:17])[c:20]1[cH:21][c:22](-[c:37]2[cH:38][c:39]([Cl:43])[cH:40][cH:41][cH:42]2)[c:23]([O:33][CH2:34][CH2:35][OH:36])[c:24](-[c:26]2[cH:27][c:28]([Cl:32])[cH:29][cH:30][cH:31]2)[cH:25]1)[CH3:44].[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:11][CH2:12][CH2:13][CH2:14][Li:15].[c:1]1([CH2:7][CH2:8][CH2:9][NH2:10])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][CH2:9][NH:10][C:19](=[O:18])[c:20]2[cH:21][c:22](-[c:37]3[cH:38][c:39]([Cl:43])[cH:40][cH:41][cH:42]3)[c:23]([O:33][CH2:34][CH2:35][OH:36])[c:24](-[c:26]3[cH:27][c:28]([Cl:32])[cH:29][cH:30][cH:31]3)[cH:25]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1