HRID733559

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID170863

Benzoyl chloride, 4-hexyl-

C13H17ClO

反应SMILES：CCCCc1ccc(C#Cc2ccc(CNc3ccc4c(c3)C(=O)OC(C)(C)O4)cc2)cc1.Cl

HCID68419698

未命名化合物

PRODUCTS

产物

反应SMILES：CCCCCCc1ccc(C(=O)N(Cc2ccc(C#Cc3ccc(CCCC)cc3)cc2)c2ccc3c(c2)C(=O)OC(C)(C)O3)cc1

HCID57841402

未命名化合物

PROCEDURE

实验过程

The titled compound was prepared following the procedure K using 6-({4-[(4-butylphenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one hydrochloride and 4-hexylbenzoyl chloride as a yellow oil (85%). HPLC, Rt: 6.45 min (Purity: 99.8%).

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-5732528423ae4ed2aff0b271679d8976
来源数据集: uspto-grants-2009_09
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US07589232B2
来源说明: uspto-grants-2009_09

反应SMILES

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