G14
Summary
| Name: | 2-phenyl-1H-imidazole-4-carboxylic acid |
| Formula: | C10 H8 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 188.183 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-phenyl-1H-imidazole-4-carboxylic acid |
| OpenEye OEToolkits | 1.5.0 | 2-phenyl-1H-imidazole-4-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c2nc(c1ccccc1)nc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)c1c[nH]c(n1)c2ccccc2 |
| SMILES | CACTVS | 3.341 | OC(=O)c1c[nH]c(n1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2[nH]cc(n2)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2[nH]cc(n2)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C10H8N2O2/c13-10(14)8-6-11-9(12-8)7-4-2-1-3-5-7/h1-6H,(H,11,12)(H,13,14) |
| InChIKey | InChI | 1.03 | XCAXKZJNJCKTQH-UHFFFAOYSA-N |
