| SpectraBase Spectrum ID |
KQHT1YNOCt8 |
| Name |
3H-Pyrazol-3-one, 2,4-dihydro-4-[[3-methoxy-4-[2-(3-methoxyphenoxy)ethoxy]phenyl]methylene]-5-methyl-2-phenyl-, (4E)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
458.184171940 u |
| Formula |
C27H26N2O5 |
| InChI |
InChI=1S/C27H26N2O5/c1-19-24(27(30)29(28-19)21-8-5-4-6-9-21)16-20-12-13-25(26(17-20)32-3)34-15-14-33-23-11-7-10-22(18-23)31-2/h4-13,16-18H,14-15H2,1-3H3/b24-16+ |
| InChIKey |
XQBFUXATXFMEHE-LFVJCYFKSA-N |
| Molecular Weight |
458.514 g/mol |
| SMILES |
C1(\C(C(=NN1C=1C=CC=CC1)C)=C\C=1C=C(OC)C(=CC1)OCCOC=1C=C(OC)C=CC1)=O |
![3H-pyrazol-3-one, 2,4-dihydro-4-[[3-methoxy-4-[2-(3-methoxyphenoxy)ethoxy]phenyl]methylene]-5-methyl-2-phenyl-, (4E)-](/api/spectrum/KQHT1YNOCt8/structure.png?h=300&w=458 "3H-pyrazol-3-one, 2,4-dihydro-4-[[3-methoxy-4-[2-(3-methoxyphenoxy)ethoxy]phenyl]methylene]-5-methyl-2-phenyl-, (4E)-")
