UK5
Summary
| Name: | 1-oxidanylquinolin-4-one |
| Formula: | C9 H7 N O2 |
| Formal charge: | 0 |
| Formula weight: | 161.157 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-oxidanylquinolin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H7NO2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H |
| InChIKey | InChI | 1.03 | AJTLULFWRGRNEZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ON1C=CC(=O)c2ccccc12 |
| SMILES | CACTVS | 3.385 | ON1C=CC(=O)c2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=O)C=CN2O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(=O)C=CN2O |
