HRID229778

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID143191

7-(Diethylamino)-2-oxo-2H-1-benzopyran-3-carbaldehyde

C14H15NO3

反应SMILES：C[N+](C)(C)CC(=O)O.Cc1cc[n+](CCCCCC(=O)O)cc1S(=O)(=O)[O-]

HCID86589123

未命名化合物

PRODUCTS

产物

反应SMILES：CCN(CC)c1ccc2cc(/C=C/c3cc[n+](CCCCCC(=O)O)cc3S(=O)(=O)[O-])c(=O)oc2c1.C[N+](C)(C)CC(=O)O

HCID86589122

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID22242641

Methanol--water (1/1)

CH6O2

PROCEDURE

实验过程

0.2 mmol 7-diethylamino-2-oxo-2H-chromene-3-carbaldehyde and 0.2 mmol 1-(5-carboxy-pentyl)-3-sulfonato-4-methyl-pyridinium betaine are converted according to the general directions above. Column chromatography: SiO2 (RP18), eluent: methanol/water.

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-76af6b9b092e42b69ef71a018a0be6e6
来源数据集: uspto-grants-2009_07
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US07563907B2
来源说明: uspto-grants-2009_07

反应SMILES

[CH2:1]([N:3]([CH2:17][CH3:18])[C:4]1[CH:13]=[C:12]2[C:7]([CH:8]=[C:9]([CH:15]=O)[C:10](=[O:14])[O:11]2)=[CH:6][CH:5]=1)[CH3:2].[C:19]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][N+:27]1[CH:32]=[CH:31][C:30]([CH3:33])=[C:29]([S:34]([O-:37])(=[O:36])=[O:35])[CH:28]=1)([OH:21])=[O:20].[CH3:38][N+:39]([CH2:42][C:43]([OH:45])=[O:44])([CH3:41])[CH3:40]>CO.O>[C:19]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][N+:27]1[CH:32]=[CH:31][C:30](/[CH:33]=[CH:15]/[C:9]2[C:10](=[O:14])[O:11][C:12]3[C:7]([CH:8]=2)=[CH:6][CH:5]=[C:4]([N:3]([CH2:17][CH3:18])[CH2:1][CH3:2])[CH:13]=3)=[C:29]([S:34]([O-:37])(=[O:36])=[O:35])[CH:28]=1)([OH:21])=[O:20].[CH3:38][N+:39]([CH2:42][C:43]([OH:45])=[O:44])([CH3:41])[CH3:40]