HKU
Summary
| Name: | 1-propan-2-ylimidazole-2-carboxylic acid |
| Formula: | C7 H10 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 154.166 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-propan-2-ylimidazole-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H10N2O2/c1-5(2)9-4-3-8-6(9)7(10)11/h3-5H,1-2H3,(H,10,11) |
| InChIKey | InChI | 1.03 | RZFBZKBGPJXOTM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)n1ccnc1C(O)=O |
| SMILES | CACTVS | 3.385 | CC(C)n1ccnc1C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)n1ccnc1C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)n1ccnc1C(=O)O |
