Q92
Summary
| Name: | 3-quinolin-6-ylbenzoic acid |
| Formula: | C16 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 249.264 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-quinolin-6-ylbenzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H11NO2/c18-16(19)14-4-1-3-11(10-14)12-6-7-15-13(9-12)5-2-8-17-15/h1-10H,(H,18,19) |
| InChIKey | InChI | 1.03 | NVUDTXCAUAPCDL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cccc(c1)c2ccc3ncccc3c2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1cccc(c1)c2ccc3ncccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)C(=O)O)c2ccc3c(c2)cccn3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)C(=O)O)c2ccc3c(c2)cccn3 |
