| SpectraBase Spectrum ID |
56BinuFqYkj |
| Name |
Methyl 6-amino-4-{5-[(4-chloro-3-methylphenoxy)methyl]-2-furyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.098249415 u |
| Formula |
C21H19ClN2O5 |
| InChI |
InChI=1S/C21H19ClN2O5/c1-11-8-13(4-6-16(11)22)27-10-14-5-7-17(29-14)19-15(9-23)20(24)28-12(2)18(19)21(25)26-3/h4-8,19H,10,24H2,1-3H3 |
| InChIKey |
PETQZIKYBRDRRZ-UHFFFAOYSA-N |
| Molecular Weight |
414.845 g/mol |
| SMILES |
NC=1OC(=C(C(C1C#N)C=1OC(COC=2C=C(C)C(=CC2)Cl)=CC1)C(=O)OC)C |
![methyl 6-amino-4-{5-[(4-chloro-3-methylphenoxy)methyl]-2-furyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate](/api/spectrum/56BinuFqYkj/structure.png?h=300&w=458 "methyl 6-amino-4-{5-[(4-chloro-3-methylphenoxy)methyl]-2-furyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate")
