| SpectraBase Spectrum ID |
Lxy0rFfoQHT |
| Name |
Ethyl 4-[4-(benzyloxy)phenyl]-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.173607257 u |
| Formula |
C27H24N2O4 |
| InChI |
InChI=1S/C27H24N2O4/c1-3-31-27(30)24-19(2)33-26(29-15-7-8-16-29)23(17-28)25(24)21-11-13-22(14-12-21)32-18-20-9-5-4-6-10-20/h4-16,25H,3,18H2,1-2H3 |
| InChIKey |
LLHHNTFBYFDJAX-UHFFFAOYSA-N |
| Molecular Weight |
440.499 g/mol |
| SMILES |
C1(=C(OC(=C(C1C1=CC=C(C=C1)OCC1=CC=CC=C1)C#N)N1C=CC=C1)C)C(=O)OCC |
![Ethyl 4-[4-(benzyloxy)phenyl]-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate](/api/spectrum/Lxy0rFfoQHT/structure.png?h=300&w=458 "Ethyl 4-[4-(benzyloxy)phenyl]-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate")
