SpectraBase Spectrum ID |
99J7RSw95kZ |
Name |
Methyl 6-amino-5-cyano-4-{5-[(4-methoxyphenoxy)methyl]-2-furyl}-2-methyl-4H-pyran-3-carboxylate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
396.132136366 u |
Formula |
C21H20N2O6 |
InChI |
InChI=1S/C21H20N2O6/c1-12-18(21(24)26-3)19(16(10-22)20(23)28-12)17-9-8-15(29-17)11-27-14-6-4-13(25-2)5-7-14/h4-9,19H,11,23H2,1-3H3 |
InChIKey |
SFBPGNHOBKHMFB-UHFFFAOYSA-N |
Molecular Weight |
396.399 g/mol |
SMILES |
NC=1OC(=C(C(C1C#N)C=1OC(COC2=CC=C(C=C2)OC)=CC1)C(=O)OC)C |