2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Chemical Structure Depiction of
2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Compound characteristics
| Compound ID: | 4483-3340 |
| Compound Name: | 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate |
| Molecular Weight: | 482.88 |
| Molecular Formula: | C24 H19 Cl N2 O7 |
| Smiles: | C1CC2CC1C1C2C(N(C1=O)c1ccccc1C(=O)OCC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1698 |
| logD: | 3.1698 |
| logSw: | -3.8562 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.609 |
| InChI Key: | SMYFSOGJBHJGKP-UHFFFAOYSA-N |