HRID1543056

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID157922

Methyl aminolevulinate

C6H11NO3

HCID601880

3-(Methoxycarbonyl)benzoic acid

C9H8O4

HCID4641409

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

C10H15N6O+

PRODUCTS

生成物

结构：COC(=O)CCC(=O)CNC(=O)c1cccc(C(=O)OC)c1

HCID21086156

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9d8ccddf60c04b0fae155613b63e725f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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