Ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
5919
Reference
Ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate Structure
Systematic / IUPAC Name: Ethyl 4-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
ID: Reference5919
Other Names: 1H-Pyrrole-3-carboxylic acid, 4-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)-1-(4-fluorophenyl)-4,5-dihydro-2-methyl-5-oxo-, ethyl ester
Formula: C25H25FN2O6
Spectral Data
Ethyl 4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-(4-fluorophenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 117 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 11/8/2016 9:30:22 AM |
Identificators
| InChI | InChI=1S/C25H25FN2O6/c1-4-33-24(31)16-6-10-18(11-7-16)27-21(29)14-20-22(25(32)34-5-2)15(3)28(23(20)30)19-12-8-17(26)9-13-19/h6-13,20H,4-5,14H2,1-3H3,(H,27,29) |
| InChI Key | HTXNQLJFRVXKOL-UHFFFAOYSA-N |
| Canonical SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=C(N(C2=O)C3=CC=C(C=C3)F)C)C(=O)OCC |
| CAS | |
| Splash | |
| Other Names | 1H-Pyrrole-3-carboxylic acid, 4-(2-{[4-(ethoxycarbonyl)phenyl]amino}-2-oxoethyl)-1-(4-fluorophenyl)-4,5-dihydro-2-methyl-5-oxo-, ethyl ester |