4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-2-methoxyphenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-2-methoxyphenyl 2-oxo-2H-1-benzopyran-3-carboxylate
4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-2-methoxyphenyl 2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 3297-1241 |
| Compound Name: | 4-(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)-2-methoxyphenyl 2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 419.39 |
| Molecular Formula: | C23 H17 N O7 |
| Smiles: | CCOC(C(=C\c1ccc(c(c1)OC)OC(C1=Cc2ccccc2OC1=O)=O)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6512 |
| logD: | 3.6512 |
| logSw: | -3.9886 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.065 |
| InChI Key: | AHZNSBUHCPENFM-UHFFFAOYSA-N |