HRID2129683

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID8028

Tetrahydrofuran

C4H8O

HCID5462224

Magnesium

结构：O=C1CCC(c2ccccc2)(c2ccccc2)C2C1CNC2C(=O)Cc1ccccc1

HCID67736934

未命名化合物

HCID178418255

未命名化合物

PRODUCTS

生成物

结构：O=C(Cc1ccccc1)C1NCC2C1C(c1ccccc1)(c1ccccc1)CCC2(O)c1ccccc1

HCID67736913

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10521e14de8a4a5499bfe26690262219
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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