ethyl 2-{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
Chemical Structure Depiction of
ethyl 2-{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
ethyl 2-{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate
Compound characteristics
| Compound ID: | 3330-4986 |
| Compound Name: | ethyl 2-{[4-(3-nitrophenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}propanoate |
| Molecular Weight: | 383.36 |
| Molecular Formula: | C20 H17 N O7 |
| Smiles: | CCOC(C(C)Oc1ccc2C(=CC(=O)Oc2c1)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.187 |
| logD: | 3.187 |
| logSw: | -3.6921 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.298 |
| InChI Key: | CSSPIWQNJFMNBN-LBPRGKRZSA-N |