HRID92873

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID24350

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

CuI

HCID70234

5-Hexyn-1-ol

C6H10O

结构：O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCCCNCC(Oc2ccc(I)cc2)C1(S(=O)(=O)c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1[N+](=O)[O-]

HCID86631580

未命名化合物

PRODUCTS

生成物

结构：O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCCCNCC(Oc2ccc(CCCCCCO)cc2)C1(S(=O)(=O)c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1[N+](=O)[O-]

HCID86631579

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bc9557c4490d41e5bad926cfd9ab29fa
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

[CH2:57]([CH2:58][CH2:59][CH2:60][C:61]#[CH:62])[OH:63].[CH2:64]1[O:65][CH2:66][CH2:67][CH2:68]1.[CH3:69][CH2:70][N:71]([CH2:72][CH3:73])[CH2:74][CH3:75].[Cu:76][I:77].[I:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH:7]2[C:8]([S:31](=[O:32])(=[O:33])[c:34]3[c:35]([N+:40](=[O:41])[O-:42])[cH:36][cH:37][cH:38][cH:39]3)([S:43](=[O:44])(=[O:45])[c:46]3[c:47]([N+:52](=[O:53])[O-:54])[cH:48][cH:49][cH:50][cH:51]3)[N:9]([S:19](=[O:20])(=[O:21])[c:22]3[c:23]([N+:28](=[O:29])[O-:30])[cH:24][cH:25][cH:26][cH:27]3)[CH2:10][CH2:11][CH2:12][NH:13][CH2:14][CH2:15][CH2:16][NH:17][CH2:18]2)[cH:55][cH:56]1>>[c:2]1([CH2:62][CH2:61][CH2:60][CH2:59][CH2:58][CH2:57][OH:63])[cH:3][cH:4][c:5]([O:6][CH:7]2[C:8]([S:31](=[O:32])(=[O:33])[c:34]3[c:35]([N+:40](=[O:41])[O-:42])[cH:36][cH:37][cH:38][cH:39]3)([S:43](=[O:44])(=[O:45])[c:46]3[c:47]([N+:52](=[O:53])[O-:54])[cH:48][cH:49][cH:50][cH:51]3)[N:9]([S:19](=[O:20])(=[O:21])[c:22]3[c:23]([N+:28](=[O:29])[O-:30])[cH:24][cH:25][cH:26][cH:27]3)[CH2:10][CH2:11][CH2:12][NH:13][CH2:14][CH2:15][CH2:16][NH:17][CH2:18]2)[cH:55][cH:56]1