8HQ
Summary
| Name: | 8-hydroxyquinoline-4-carboxylic acid |
| Formula: | C10 H7 N O3 |
| Formal charge: | 0 |
| Formula weight: | 189.167 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 8-hydroxyquinoline-4-carboxylic acid |
| OpenEye OEToolkits | 1.9.2 | 8-oxidanylquinoline-4-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1c2cccc(O)c2ncc1 |
| InChI | InChI | 1.03 | InChI=1S/C10H7NO3/c12-8-3-1-2-6-7(10(13)14)4-5-11-9(6)8/h1-5,12H,(H,13,14) |
| InChIKey | InChI | 1.03 | KPTUKANGPPVLMD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccnc2c(O)cccc12 |
| SMILES | CACTVS | 3.385 | OC(=O)c1ccnc2c(O)cccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc2c(ccnc2c(c1)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cc2c(ccnc2c(c1)O)C(=O)O |
