HRID291860

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8085

2-Methyl-N-(2-methylpropyl)-1-propanamine

C8H19N

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

结构：c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1

HCID2724700

未命名化合物

结构：Cc1cc(C)cc(-c2[nH]c3ncc(C(C)(C)C(=O)O)cc3c2C(C)COCc2ccccc2)c1

HCID21998693

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C)cc(-c2[nH]c3ncc(C(C)(C)C(=O)N(CC(C)C)CC(C)C)cc3c2C(C)COCc2ccccc2)c1

HCID18779660

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-875f5d4599a141dd902c6fda5aa4dfbf
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

[CH2:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[O:41][CH2:42][CH:43]([CH3:44])[c:45]1[c:46](-[c:60]2[cH:61][c:62]([CH3:67])[cH:63][c:64]([CH3:66])[cH:65]2)[nH:47][c:48]2[n:49][cH:50][c:51]([C:54]([C:55](=[O:56])[OH:57])([CH3:58])[CH3:59])[cH:52][c:53]12.[CH2:68]([CH:69]([CH3:70])[CH3:71])[NH:72][CH2:73][CH:74]([CH3:75])[CH3:76].[CH3:77][CH2:78][N:79]([CH2:80][CH3:81])[CH2:82][CH3:83].[Cl:84][CH2:85][Cl:86].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][P+:10]([N:11]2[CH2:12][CH2:13][CH2:14][CH2:15]2)([N:16]2[CH2:17][CH2:18][CH2:19][CH2:20]2)[N:21]2[CH2:22][CH2:23][CH2:24][CH2:25]2)[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1>>[CH2:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[O:41][CH2:42][CH:43]([CH3:44])[c:45]1[c:46](-[c:60]2[cH:61][c:62]([CH3:67])[cH:63][c:64]([CH3:66])[cH:65]2)[nH:47][c:48]2[n:49][cH:50][c:51]([C:54]([C:55](=[O:56])[N:72]([CH2:68][CH:69]([CH3:70])[CH3:71])[CH2:73][CH:74]([CH3:75])[CH3:76])([CH3:58])[CH3:59])[cH:52][c:53]12