1R5
Summary
| Name: | 7-(4-fluorophenyl)-3-hydroxyquinolin-2(1H)-one |
| Formula: | C15 H10 F N O2 |
| Formal charge: | 0 |
| Formula weight: | 255.244 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-(4-fluorophenyl)-3-hydroxyquinolin-2(1H)-one |
| OpenEye OEToolkits | 1.7.6 | 7-(4-fluorophenyl)-3-oxidanyl-1H-quinolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc3ccc(c1ccc2c(c1)NC(=O)C(O)=C2)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H10FNO2/c16-12-5-3-9(4-6-12)10-1-2-11-8-14(18)15(19)17-13(11)7-10/h1-8,18H,(H,17,19) |
| InChIKey | InChI | 1.03 | YFFXAOFQLPIPER-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC1=Cc2ccc(cc2NC1=O)c3ccc(F)cc3 |
| SMILES | CACTVS | 3.370 | OC1=Cc2ccc(cc2NC1=O)c3ccc(F)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2ccc3c(c2)NC(=O)C(=C3)O)F |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2ccc3c(c2)NC(=O)C(=C3)O)F |
