HRID2311009

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID89715

1,3-Benzenediamine, N,N,N',N'-tetramethyl-

C10H16N2

反应SMILES：CN(C)c1ccc(C2OC(=O)c3cc(N(C)C)ccc32)cc1

HCID93693

1(3H)-Isobenzofuranone, 6-(dimethylamino)-3-[4-(dimethylamino)phenyl]-

C18H20N2O2

PRODUCTS

产物

反应SMILES：CN(C)c1ccc(C(c2ccc(N(C)C)cc2C(=O)O)c2ccc(N(C)C)cc2N(C)C)cc1

HCID112438

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-8a3ee5360c9b465bb6fe48ad56ee5391
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应SMILES

[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[O:10][C:11](=[O:12])[c:13]3[cH:14][c:15]([N:19]([CH3:20])[CH3:21])[cH:16][cH:17][c:18]32)[cH:7][cH:8]1)[CH3:22].[CH3:23][N:24]([c:25]1[cH:26][c:27]([N:31]([CH3:32])[CH3:33])[cH:28][cH:29][cH:30]1)[CH3:34].[ClH:37].[K+:36].[OH-:35].[OH2:38]>>[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]([c:18]2[c:13]([C:11]([OH:10])=[O:12])[cH:14][c:15]([N:19]([CH3:20])[CH3:21])[cH:16][cH:17]2)[c:28]2[c:27]([N:31]([CH3:32])[CH3:33])[cH:26][c:25]([N:24]([CH3:23])[CH3:34])[cH:30][cH:29]2)[cH:7][cH:8]1)[CH3:22]