9ME
Summary
| Name: | (4-fluoranyl-3-oxidanyl-phenyl)-quinolin-2-yl-methanone |
| Formula: | C16 H10 F N O2 |
| Formal charge: | 0 |
| Formula weight: | 267.255 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (4-fluoranyl-3-oxidanyl-phenyl)-quinolin-2-yl-methanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H10FNO2/c17-12-7-5-11(9-15(12)19)16(20)14-8-6-10-3-1-2-4-13(10)18-14/h1-9,19H |
| InChIKey | InChI | 1.03 | JNWWABLECBACFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cc(ccc1F)C(=O)c2ccc3ccccc3n2 |
| SMILES | CACTVS | 3.385 | Oc1cc(ccc1F)C(=O)c2ccc3ccccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)ccc(n2)C(=O)c3ccc(c(c3)O)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)ccc(n2)C(=O)c3ccc(c(c3)O)F |
