HRID124721

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID313

Hydrochloric Acid

ClH

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID247332

2-Chloro-alpha-(4-chlorophenyl)benzenemethanol

C13H10Cl2O

HCID2832202

1-Azabicyclo[2.2.2]octane-3-carboxylic acid

C8H13NO2

PRODUCTS

生成物

结构：O=C(OC(c1ccc(Cl)cc1)c1ccccc1Cl)C1CN2CCC1CC2

HCID70925811

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-79843a04d2114a8588841f34eb9f5c3f
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

[CH2:13]([Cl:14])[CH2:15][Cl:16].[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:27][c:28]1[c:29]([CH:34]([OH:35])[c:36]2[cH:37][cH:38][c:39]([Cl:42])[cH:40][cH:41]2)[cH:30][cH:31][cH:32][cH:33]1.[ClH:1].[N:2]12[CH2:3][CH:4]([C:10](=[O:11])[OH:12])[CH:5]([CH2:6][CH2:7]1)[CH2:8][CH2:9]2.[OH:17][n:18]1[c:19]2[c:20]([cH:21][cH:22][cH:23][cH:24]2)[n:25][n:26]1>>[N:2]12[CH2:3][CH:4]([C:10](=[O:11])[O:12][CH:34]([c:29]3[c:28]([Cl:27])[cH:33][cH:32][cH:31][cH:30]3)[c:36]3[cH:37][cH:38][c:39]([Cl:42])[cH:40][cH:41]3)[CH:5]([CH2:6][CH2:7]1)[CH2:8][CH2:9]2