HRID319868

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

3 次

HCID923

Sodium ion

Na+

HCID1061

Phosphate

O4P-3

HCID24350

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

CuI

HCID141645

Benzene, 1-iodo-2,3-dimethyl-

C8H9I

HCID551074

N,N'-Dimethyl-1,2-cyclohexanediamine

C8H18N2

结构：O=c1[nH]nc2c3ccccc3n(Cc3ccc(-n4cccn4)cc3)nc1-2

HCID68785789

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(-n2nc3c4ccccc4n(Cc4ccc(-n5cccn5)cc4)nc-3c2=O)c1C

HCID46896708

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dbc41782664144afac7e427ff94866e2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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