| SpectraBase Spectrum ID |
B43fqdFZMwa |
| Name |
3-Amino-2-chloro-5-cyano-6-fluoro-4-phenylethynyl-benzoic acid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H12ClFN2O2 |
| InChI |
InChI=1S/C18H12ClFN2O2/c1-2-24-18(23)14-15(19)17(22)12(13(10-21)16(14)20)9-8-11-6-4-3-5-7-11/h3-7H,2,22H2,1H3 |
| InChIKey |
UDBLZYZREWQLEW-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol7025872 |
| Molecular Weight |
342.757 g/mol |
| SMILES |
Nc1c(c(C#N)c(c(c1Cl)C(OCC)=O)F)C#Cc1ccccc1 |
| SPLASH |
splash10-0006-1098000000-fe0ed07bf7570b05c2b1 |
| Source of Spectrum |
A1-10-113/SM10-2e |
| Synonyms |
Ethyl 3-amino-2-chloro-5-cyano-6-fluoro-4-(phenylethynyl)benzoate |
| Wiley ID |
1758927 |
