| SpectraBase Spectrum ID |
5bh7nWf01F3 |
| Name |
Ethyl 2-acetylamino-2-cyano-3-(4-nitrophenyl)-5-oxo-5-(4-fluorophenyl)pentanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H20FN3O6 |
| InChI |
InChI=1S/C22H20FN3O6/c1-3-32-21(29)22(13-24,25-14(2)27)19(15-6-10-18(11-7-15)26(30)31)12-20(28)16-4-8-17(23)9-5-16/h4-11,19H,3,12H2,1-2H3,(H,25,27) |
| InChIKey |
XJBILYKHTSHCLJ-UHFFFAOYSA-N |
| Molecular Weight |
441.415 g/mol |
| SMILES |
N(C(C(=O)OCC)(C(CC(c1ccc(cc1)F)=O)c1ccc(cc1)N(=O)=O)C#N)C(=O)C |
| SPLASH |
splash10-00di-0920000000-290624c4cf46cdf2cffd |
| Source of Spectrum |
CV-2004-1024-6 |
| Synonyms |
Ethyl 2-(acetylamino)-2-cyano-5-(4-fluorophenyl)-3-(4-nitrophenyl)-5-oxopentanoate |
| Wiley ID |
1611267 |
