QXO
Summary
| Name: | 2-(6-fluoranylindol-1-yl)ethanoic acid |
| Synonyms: | 2-(6-fluoro-1H-indol-1-yl)acetic acid |
| Formula: | C10 H8 F N O2 |
| Formal charge: | 0 |
| Formula weight: | 193.174 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-(6-fluoranylindol-1-yl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H8FNO2/c11-8-2-1-7-3-4-12(6-10(13)14)9(7)5-8/h1-5H,6H2,(H,13,14) |
| InChIKey | InChI | 1.06 | UVPVRQIYZWPBEJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)Cn1ccc2ccc(F)cc12 |
| SMILES | CACTVS | 3.385 | OC(=O)Cn1ccc2ccc(F)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc2c1ccn2CC(=O)O)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc2c1ccn2CC(=O)O)F |
