HRID802471

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID66036

4-Chlorobenzylamine

C7H8ClN

HCID81531

Diisopropylethylamine

C8H19N

结构：CC(C)(C)OC(=O)NC1(C(=O)O)CCN(C(=O)OC(C)(C)C)CC1

HCID1268225

1-(tert-Butoxycarbonyl)-4-[(tert-butoxycarbonyl)amino]piperidine-4-carboxylic acid

C16H28N2O6

HCID4641409

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

C10H15N6O+

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(Cl)cc2)CCN(C(=O)OC(C)(C)C)CC1

HCID45139444

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1f551ea817554e318901206edcec1fd5
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[OH:16])([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:12][CH2:13]1.[CH2:49]([N:50]([CH:51]([CH3:52])[CH3:53])[CH:54]([CH3:55])[CH3:56])[CH3:57].[Cl:58][c:59]1[cH:60][cH:61][c:62]([CH2:63][NH2:64])[cH:65][cH:66]1.[Cl:68][CH2:69][Cl:70].[O:71]=[CH:72][N:73]([CH3:74])[CH3:75].[OH2:67].[P-:25]([F:26])([F:27])([F:28])([F:29])([F:30])[F:31].[n:32]1([O:33][C:34]([N:35]([CH3:36])[CH3:37])=[N+:38]([CH3:39])[CH3:40])[c:41]2[n:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11]([C:14](=[O:15])[NH:64][CH2:63][c:62]2[cH:61][cH:60][c:59]([Cl:58])[cH:66][cH:65]2)([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:12][CH2:13]1