HRID948908

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6422

未命名化合物

HCID7404

Benzenesulfonyl chloride, 4-nitro-

C6H4ClNO4S

HCID84468

Trifluoroacetate

C2F3O2-

结构：CC(C)(C)OC(=O)NC(CCCCNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

HCID334924

未命名化合物

PRODUCTS

生成物

结构：O=C(NCCCCC(NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)O)OCC1c2ccccc2-c2ccccc21

HCID178523326

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3748acba62dd4de48465d88dab95836a
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

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