| SpectraBase Spectrum ID |
gfZTmmZkUB |
| Name |
[1-Methoxy-4-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene-methyl-phenoxy]acetic acid, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.152871811 u |
| Formula |
C22H22N2O5 |
| InChI |
InChI=1S/C22H22N2O5/c1-4-28-21(25)14-29-19-11-10-16(13-20(19)27-3)12-18-15(2)23-24(22(18)26)17-8-6-5-7-9-17/h5-13H,4,14H2,1-3H3/b18-12- |
| InChIKey |
WACIBPZISZOWNC-PDGQHHTCSA-N |
| Molecular Weight |
394.427 g/mol |
| SMILES |
C1=C(C(=CC=C1\C=C\1C(=NN(C1=O)C1=CC=CC=C1)C)OCC(OCC)=O)OC |
![[1-Methoxy-4-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene-methyl-phenoxy]acetic acid, ethyl ester](/api/spectrum/gfZTmmZkUB/structure.png?h=300&w=458 "[1-Methoxy-4-(3-methyl-5-oxo-1-phenyl-1,5-dihydropyrazol-4-ylidene-methyl-phenoxy]acetic acid, ethyl ester")
