| SpectraBase Spectrum ID |
3ZTcQAAF06j |
| Name |
4-(5-(2-Methoxyphenyl)-4-(ethoxycarbonyl)-3-oxo-2,3-dihydropyrazol-1-yl)benzoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H18N2O6 |
| InChI |
InChI=1S/C20H18N2O6/c1-3-28-20(26)16-17(14-6-4-5-7-15(14)27-2)22(21-18(16)23)13-10-8-12(9-11-13)19(24)25/h4-11H,3H2,1-2H3,(H,21,23)(H,24,25) |
| InChIKey |
VZEMMSYZGBBVRW-UHFFFAOYSA-N |
| Molecular Weight |
382.372 g/mol |
| SMILES |
N1N(c2ccc(C(=O)O)cc2)C(=C(C(=O)OCC)C1=O)c1c(OC)cccc1 |
| SPLASH |
splash10-001i-0009000000-ccf6b1c278eda48d2694 |
| Source of Spectrum |
F2-44-4631-4g |
| Synonyms |
4-[4-ethoxycarbonyl-3-(2-methoxyphenyl)-5-oxo-1H-pyrazol-2-yl]benzoic acid
4-[4-ethoxycarbonyl-3-(2-methoxyphenyl)-5-oxidanylidene-1H-pyrazol-2-yl]benzoic acid |
| Wiley ID |
1705845 |
