WQS
Summary
| Name: | 2-[(3S)-5-fluoranyl-2-oxidanylidene-1,3-dihydroindol-3-yl]ethanoic acid |
| Formula: | C10 H8 F N O3 |
| Formal charge: | 0 |
| Formula weight: | 209.174 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 2-[(3S)-5-fluoranyl-2-oxidanylidene-1,3-dihydroindol-3-yl]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H8FNO3/c11-5-1-2-8-6(3-5)7(4-9(13)14)10(15)12-8/h1-3,7H,4H2,(H,12,15)(H,13,14)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | GOJAJUSLXBXIJY-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C[C@@H]1C(=O)Nc2ccc(F)cc12 |
| SMILES | CACTVS | 3.385 | OC(=O)C[CH]1C(=O)Nc2ccc(F)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1F)[C@@H](C(=O)N2)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1F)C(C(=O)N2)CC(=O)O |
