ethyl 3-{4-[bis(acetyloxy)methyl]-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl}benzoate
Chemical Structure Depiction of
ethyl 3-{4-[bis(acetyloxy)methyl]-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl}benzoate
ethyl 3-{4-[bis(acetyloxy)methyl]-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl}benzoate
Compound characteristics
| Compound ID: | 4373-3496 |
| Compound Name: | ethyl 3-{4-[bis(acetyloxy)methyl]-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl}benzoate |
| Molecular Weight: | 443.41 |
| Molecular Formula: | C22 H21 N O9 |
| Smiles: | CCOC(c1cccc(c1)N1C(C2C(C1=O)C1(C=CC2O1)C(OC(C)=O)OC(C)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3199 |
| logD: | 1.3199 |
| logSw: | -2.0658 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 99.622 |
| InChI Key: | UFHDQKZEMIEXQO-UHFFFAOYSA-N |