HRID1127732

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

2 次

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

结构：O=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21

HCID1969277

1-(diphenylmethyl)-1H-indole-2,3-dione

C21H15NO2

HCID12236542

Chroman-7-ol

C9H10O2

HCID178461726

未命名化合物

PRODUCTS

生成物

结构：O=C1N(C(c2ccccc2)c2ccccc2)c2ccccc2C1(O)c1cc2c(cc1O)OCCC2

HCID68597079

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-df77e249a68a4701b4569c4536c11b36
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH:13]([Mg+:14])([CH3:15])[CH3:16].[Cl-:12].[Cl-:49].[Cl:46][CH2:47][Cl:48].[NH4+:50].[O:1]1[CH2:2][CH2:3][CH2:4][c:5]2[cH:6][cH:7][c:8]([OH:11])[cH:9][c:10]21.[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[c:17]1([CH:23]([N:24]2[C:25](=[O:34])[C:26](=[O:33])[c:27]3[cH:28][cH:29][cH:30][cH:31][c:32]32)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[O:1]1[CH2:2][CH2:3][CH2:4][c:5]2[cH:6][c:7]([C:26]3([OH:33])[C:25](=[O:34])[N:24]([CH:23]([c:17]4[cH:18][cH:19][cH:20][cH:21][cH:22]4)[c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[c:32]4[c:27]3[cH:28][cH:29][cH:30][cH:31]4)[c:8]([OH:11])[cH:9][c:10]21