FLP
Summary
| Name: | FLURBIPROFEN |
| Formula: | C15 H13 F O2 |
| Formal charge: | 0 |
| Formula weight: | 244.261 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-2-(2-fluorobiphenyl-4-yl)propanoic acid |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-(3-fluoro-4-phenyl-phenyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Fc2cc(ccc2c1ccccc1)C(C(=O)O)C |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](C(O)=O)c1ccc(c(F)c1)c2ccccc2 |
| SMILES | CACTVS | 3.341 | C[CH](C(O)=O)c1ccc(c(F)c1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](c1ccc(c(c1)F)c2ccccc2)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(c1ccc(c(c1)F)c2ccccc2)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | SYTBZMRGLBWNTM-JTQLQIEISA-N |
