HRID833198

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID3776

Isopropanol

C3H8O

HCID6344

Dichloromethane

CH2Cl2

HCID8028

Tetrahydrofuran

C4H8O

HCID138823

Cyclopropylacetylene

C5H6

结构：COCCOCOc1ccc(NC(=O)OC(C)(C)C)c(C(=O)C(F)(F)F)c1

HCID68801075

未命名化合物

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COCCOCOc1ccc(NC(=O)OC(C)(C)C)c(C(O)(C#CC2CC2)C(F)(F)F)c1

HCID68800268

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-61522162e0fb42dcb13c97ea9936adbb
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16]([NH:17][c:18]1[c:19]([C:31]([C:32]([F:33])([F:34])[F:35])=[O:36])[cH:20][c:21]([O:24][CH2:25][O:26][CH2:27][CH2:28][O:29][CH3:30])[cH:22][cH:23]1)=[O:37].[C:1](#[CH:2])[CH:3]1[CH2:4][CH2:5]1.[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH2:6]([Li:7])[CH2:8][CH2:9][CH3:10].[CH:43]([OH:44])([CH3:45])[CH3:46].[Cl-:38].[Cl:40][CH2:41][Cl:42].[NH4+:39]>>[C:1](#[C:2][C:31]([c:19]1[c:18]([NH:17][C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:37])[cH:23][cH:22][c:21]([O:24][CH2:25][O:26][CH2:27][CH2:28][O:29][CH3:30])[cH:20]1)([C:32]([F:33])([F:34])[F:35])[OH:36])[CH:3]1[CH2:4][CH2:5]1