A1JHB
Summary
| Name: | 6-[2-(2-fluorophenyl)ethoxy]-2,3-dihydrophthalazine-1,4-dione |
| Formula: | C16 H13 F N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 300.284 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-[2-(2-fluorophenyl)ethoxy]-2,3-dihydrophthalazine-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H13FN2O3/c17-14-4-2-1-3-10(14)7-8-22-11-5-6-12-13(9-11)16(21)19-18-15(12)20/h1-6,9H,7-8H2,(H,18,20)(H,19,21) |
| InChIKey | InChI | 1.06 | YEMZLKBVSQOAOO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccccc1CCOc2ccc3C(=O)NNC(=O)c3c2 |
| SMILES | CACTVS | 3.385 | Fc1ccccc1CCOc2ccc3C(=O)NNC(=O)c3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)CCOc2ccc3c(c2)C(=O)NNC3=O)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)CCOc2ccc3c(c2)C(=O)NNC3=O)F |
