HRID192305

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID75182

Benzoic acid, 4-phenoxy-

C13H10O3

结构：c1ccc2c(c1)nnn2O[P+](N1CCCC1)(N1CCCC1)N1CCCC1

HCID2724700

未命名化合物

HCID14627375

1,3'-Bipyrrolidine

C8H16N2

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：O=C(c1ccc(Oc2ccccc2)cc1)N1CCC(N2CCCC2)C1

HCID59012018

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-27faf5dfe99644a29a9437d8c4085f25
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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