LT8
Summary
| Name: | 2-pyrazol-1-ylbenzoic acid |
| Formula: | C10 H8 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 188.183 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-pyrazol-1-ylbenzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H8N2O2/c13-10(14)8-4-1-2-5-9(8)12-7-3-6-11-12/h1-7H,(H,13,14) |
| InChIKey | InChI | 1.03 | MHACZVWKWUMHRR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccccc1n2cccn2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1ccccc1n2cccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C(=O)O)n2cccn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C(=O)O)n2cccn2 |
