HRID1570092

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID14855681

Pyrrolidine-1-butyric acid

C8H15NO2

结构：CC(CCCc1ccc(F)cc1)c1cc(O)c2c(c1)OC(C)(C)C1=C2CCC1

HCID21409749

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：CC(CCCc1ccc(F)cc1)c1cc(OC(=O)CCCN2CCCC2)c2c(c1)OC(C)(C)C1=C2CCC1

HCID54158941

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d9a7cec46a54714a3f450fc6827b78a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[CH2:56]([Cl:57])[Cl:58].[CH3:1][C:2]1([CH3:28])[O:3][c:4]2[c:5]([c:11]([OH:27])[cH:12][c:13]([CH:15]([CH2:16][CH2:17][CH2:18][c:19]3[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]3)[CH3:26])[cH:14]2)[C:6]2=[C:7]1[CH2:8][CH2:9][CH2:10]2.[CH:41]1([N:42]=[C:43]=[N:44][CH:45]2[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50]2)[CH2:51][CH2:52][CH2:53][CH2:54][CH2:55]1.[ClH:29].[N:30]1([CH2:35][CH2:36][CH2:37][C:38](=[O:39])[OH:40])[CH2:31][CH2:32][CH2:33][CH2:34]1>>[CH3:1][C:2]1([CH3:28])[O:3][c:4]2[c:5]([c:11]([O:27][C:38]([CH2:37][CH2:36][CH2:35][N:30]3[CH2:31][CH2:32][CH2:33][CH2:34]3)=[O:39])[cH:12][c:13]([CH:15]([CH2:16][CH2:17][CH2:18][c:19]3[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]3)[CH3:26])[cH:14]2)[C:6]2=[C:7]1[CH2:8][CH2:9][CH2:10]2.[ClH:29]