HRID1554089

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID947

Nitrogen

HCID8058

n-Hexane

C6H14

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID11776

Triphenylphosphine

C18H15P

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID66111

Trimethylsilylacetylene

C5H10Si

HCID18459001

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC1COc1cncc(C#C[Si](C)(C)C)c1

HCID76371328

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9cd704ec6727487c95ef8eab09dd59f8
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

[Br:1][c:2]1[cH:3][n:4][cH:5][c:6]([O:8][CH2:9][CH:10]2[N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]2)[cH:7]1.[CH3:40][Si:41]([CH3:42])([CH3:43])[C:44]#[CH:45].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[CH3:56][CH2:57][CH2:58][CH2:59][CH2:60][CH3:61].[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[Cu:48][I:49].[N:46]#[N:47].[c:21]1([P:22]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[c:2]1([C:45]#[C:44][Si:41]([CH3:40])([CH3:42])[CH3:43])[cH:3][n:4][cH:5][c:6]([O:8][CH2:9][CH:10]2[N:11]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH2:12][CH2:13]2)[cH:7]1