| SpectraBase Spectrum ID |
54gfXRxPhcc |
| Name |
2-cyano-2-(2-keto-3-nitro-1-phenyl-4-quinolyl)acetic acid ethyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H15N3O5 |
| InChI |
InChI=1S/C20H15N3O5/c1-2-28-20(25)15(12-21)17-14-10-6-7-11-16(14)22(13-8-4-3-5-9-13)19(24)18(17)23(26)27/h3-11,15H,2H2,1H3 |
| InChIKey |
BZWWOKOOYIIXNJ-UHFFFAOYSA-N |
| Molecular Weight |
377.356 g/mol |
| SMILES |
C=1(C(N(c2ccccc2)c2c(C1C(C(=O)OCC)C#N)cccc2)=O)N(=O)=O |
| SPLASH |
splash10-004i-0009000000-c126c2f0c8da0bd87b62 |
| Source of Spectrum |
AJ-43-122-4 |
| Synonyms |
2-cyano-2-(3-nitro-2-oxo-1-phenyl-4-quinolinyl)acetic acid ethyl ester
ethyl 2-cyano-2-(3-nitro-2-oxidanylidene-1-phenyl-quinolin-4-yl)ethanoate
ethyl 2-cyano-2-(3-nitro-2-oxo-1-phenyl-4-quinolyl)acetate
ethyl 2-cyano-2-(3-nitro-2-oxo-1-phenylquinolin-4-yl)acetate |
| Wiley ID |
1593816 |
