A1H6K
Summary
| Name: | 2-[6-(4-chlorophenyl)imidazo[1,2-b]pyridazin-2-yl]ethanoic acid |
| Formula: | C14 H10 Cl N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 287.701 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[6-(4-chlorophenyl)imidazo[1,2-b]pyridazin-2-yl]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H10ClN3O2/c15-10-3-1-9(2-4-10)12-5-6-13-16-11(7-14(19)20)8-18(13)17-12/h1-6,8H,7H2,(H,19,20) |
| InChIKey | InChI | 1.06 | CYEABSUHPBMHRO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)Cc1cn2nc(ccc2n1)c3ccc(Cl)cc3 |
| SMILES | CACTVS | 3.385 | OC(=O)Cc1cn2nc(ccc2n1)c3ccc(Cl)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1c2ccc3nc(cn3n2)CC(=O)O)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1c2ccc3nc(cn3n2)CC(=O)O)Cl |
