HRID136466

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID7972

4-Methylmorpholine

C5H11NO

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID125395

Pyrene-1-carboxylic acid

C17H10O2

结构：O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCCNCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])Cc2cccc(n2)C1

HCID10555399

未命名化合物

PRODUCTS

生成物

结构：O=C(c1ccc2ccc3cccc4ccc1c2c34)N1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])Cc2cccc(n2)CN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1

HCID10819215

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-68d3ac4f97aa4b658b0b592c7200cf19
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH3:85][N:86]1[CH2:87][CH2:88][O:89][CH2:90][CH2:91]1.[CH:60]1([N:61]=[C:62]=[N:63][CH:64]2[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]2)[CH2:70][CH2:71][CH2:72][CH2:73][CH2:74]1.[Cl:92][CH2:93][Cl:94].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10](=[O:11])(=[O:12])[N:13]2[CH2:14][c:15]3[cH:16][cH:17][cH:18][c:19]([n:40]3)[CH2:20][N:21]([S:28](=[O:29])(=[O:30])[c:31]3[c:32]([N+:37](=[O:38])[O-:39])[cH:33][cH:34][cH:35][cH:36]3)[CH2:22][CH2:23][CH2:24][NH:25][CH2:26][CH2:27]2)[cH:6][cH:7][cH:8][cH:9]1.[O:95]=[CH:96][N:97]([CH3:98])[CH3:99].[OH:75][n:76]1[c:77]2[c:78]([cH:79][cH:80][cH:81][cH:82]2)[n:83][n:84]1.[c:41]1([C:57](=[O:58])[OH:59])[cH:42][cH:43][c:44]2[cH:45][cH:46][c:47]3[cH:48][cH:49][cH:50][c:51]4[cH:52][cH:53][c:54]1[c:55]2[c:56]34>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10](=[O:11])(=[O:12])[N:13]2[CH2:14][c:15]3[cH:16][cH:17][cH:18][c:19]([n:40]3)[CH2:20][N:21]([S:28](=[O:29])(=[O:30])[c:31]3[c:32]([N+:37](=[O:38])[O-:39])[cH:33][cH:34][cH:35][cH:36]3)[CH2:22][CH2:23][CH2:24][N:25]([C:57]([c:41]3[cH:42][cH:43][c:44]4[cH:45][cH:46][c:47]5[cH:48][cH:49][cH:50][c:51]6[cH:52][cH:53][c:54]3[c:55]4[c:56]56)=[O:58])[CH2:26][CH2:27]2)[cH:6][cH:7][cH:8][cH:9]1