HRID92749

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID82693

5-Chloroindole-2-carboxylate

C9H6ClNO2

HCID85794

2-Amino-2,3-dihydro-1H-inden-1-ol

C9H11NO

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

PRODUCTS

生成物

结构：O=C(NC1Cc2ccccc2C1O)c1cc2cc(Cl)ccc2[nH]1

HCID21883965

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-66b9cfa7542b4920a02880e196124c98
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

[CH:14]([N:15]([CH2:16][CH3:17])[CH:18]([CH3:19])[CH3:20])([CH3:21])[CH3:22].[Cl:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:11](=[O:12])[OH:13])[nH:7][c:8]2[cH:9][cH:10]1.[Cl:58][CH2:59][Cl:60].[NH2:23][CH:24]1[CH:25]([OH:33])[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[CH2:32]1.[P-:34]([F:35])([F:36])([F:37])([F:38])([F:39])[F:40].[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[n:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[Cl:1][c:2]1[cH:3][c:4]2[cH:5][c:6]([C:11](=[O:13])[NH:23][CH:24]3[CH:25]([OH:33])[c:26]4[cH:27][cH:28][cH:29][cH:30][c:31]4[CH2:32]3)[nH:7][c:8]2[cH:9][cH:10]1