1-oxo-2-phenyl-1H-inden-3-yl 2-nitrobenzoate
Chemical Structure Depiction of
1-oxo-2-phenyl-1H-inden-3-yl 2-nitrobenzoate
1-oxo-2-phenyl-1H-inden-3-yl 2-nitrobenzoate
Compound characteristics
| Compound ID: | 0094-0336 |
| Compound Name: | 1-oxo-2-phenyl-1H-inden-3-yl 2-nitrobenzoate |
| Molecular Weight: | 371.35 |
| Molecular Formula: | C22 H13 N O5 |
| Smiles: | c1ccc(cc1)C1=C(c2ccccc2C1=O)OC(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3403 |
| logD: | 4.3403 |
| logSw: | -4.7111 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.176 |
| InChI Key: | BTEIBMKTDYQKDD-UHFFFAOYSA-N |