HRID1573241

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID10331

2-Benzofurancarboxylic acid

C9H6O3

HCID75654

Diphenyl phosphorochloridate

C12H10ClO3P

HCID22311378

未命名化合物

结构：Cc1ccc(C(=O)OC(C(=O)O)(C(=O)c2ccc(C)cc2)C(O)C(=O)O)cc1

HCID53442768

未命名化合物

PRODUCTS

生成物

结构：O=C(NC1C2CCN(CC2)C1Cc1cccnc1)c1cc2ccccc2o1

HCID22311391

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d6f775b704e34f429e8e7eab41903dcb
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

[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[Cl:83][CH2:84][Cl:85].[NH2:37][CH:38]1[CH:39]([CH2:46][c:47]2[cH:48][n:49][cH:50][cH:51][cH:52]2)[N:40]2[CH2:41][CH2:42][CH:43]1[CH2:44][CH2:45]2.[Na+:82].[OH-:81].[c:1]1([O:2][P:3]([Cl:4])([O:5][c:6]2[cH:7][cH:8][cH:9][cH:10][cH:11]2)=[O:12])[cH:13][cH:14][cH:15][cH:16][cH:17]1.[c:53]1([CH3:54])[cH:55][cH:56][c:57]([C:58]([O:59][C:60]([C:61]([c:62]2[cH:63][cH:64][c:65]([CH3:66])[cH:67][cH:68]2)=[O:69])([CH:70]([C:71]([OH:72])=[O:73])[OH:74])[C:75]([OH:76])=[O:77])=[O:78])[cH:79][cH:80]1.[o:18]1[c:19]([C:27](=[O:28])[OH:29])[cH:20][c:21]2[c:22]1[cH:23][cH:24][cH:25][cH:26]2>>[o:18]1[c:19]([C:27](=[O:29])[NH:37][CH:38]2[CH:39]([CH2:46][c:47]3[cH:48][n:49][cH:50][cH:51][cH:52]3)[N:40]3[CH2:41][CH2:42][CH:43]2[CH2:44][CH2:45]3)[cH:20][c:21]2[c:22]1[cH:23][cH:24][cH:25][cH:26]2