| SpectraBase Spectrum ID |
GpK4JUiFuOi |
| Name |
2-(4-{(Z)-[1-(2-Cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenoxy)-N-phenylacetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.164105200 u |
| Formula |
C23H22N4O4 |
| InChI |
InChI=1S/C23H22N4O4/c1-16-19(23(29)27(26-16)12-6-11-24)13-17-9-10-20(21(14-17)30-2)31-15-22(28)25-18-7-4-3-5-8-18/h3-5,7-10,13-14H,6,12,15H2,1-2H3,(H,25,28)/b19-13- |
| InChIKey |
MMHSBCLSZHBMPB-UYRXBGFRSA-N |
| Molecular Weight |
418.453 g/mol |
| SMILES |
N(C(COC1=CC=C(\C=C/2C(N(CCC#N)N=C2C)=O)C=C1OC)=O)C=1C=CC=CC1 |
![2-(4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenoxy)-N-phenylacetamide](/api/spectrum/GpK4JUiFuOi/structure.png?h=300&w=458 "2-(4-{(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenoxy)-N-phenylacetamide")
