89Z
Summary
| Name: | 6-(cyclopentylmethoxy)phthalazine-1,4-dione |
| Formula: | C14 H14 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 258.273 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-(cyclopentylmethoxy)phthalazine-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H14N2O3/c17-13-11-6-5-10(7-12(11)14(18)16-15-13)19-8-9-3-1-2-4-9/h5-7,9H,1-4,8H2 |
| InChIKey | InChI | 1.06 | NLZNAPGLASOXSV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1N=NC(=O)c2cc(OCC3CCCC3)ccc12 |
| SMILES | CACTVS | 3.385 | O=C1N=NC(=O)c2cc(OCC3CCCC3)ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1OCC3CCCC3)C(=O)N=NC2=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1OCC3CCCC3)C(=O)N=NC2=O |
