HRID946613

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID679

Dimethyl sulfoxide

C2H6OS

HCID887

Methanol

CH4O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7448

Benzoic acid, 2-chloro-4-nitro-

C7H4ClNO4

HCID8471

Triethylamine

C6H15N

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID408343

Diethyl 2-aminopentanedioate

C9H17NO4

PRODUCTS

生成物

结构：CCOC(=O)CCC(NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)OCC

HCID178471650

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-295e2d3d33804715bea3840bc0067d7f
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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