HLL
Summary
| Name: | 1-[2-(1,2,3-triazol-1-yl)ethyl]imidazole-2-carboxylic acid |
| Formula: | C8 H9 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 207.189 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[2-(1,2,3-triazol-1-yl)ethyl]imidazole-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H9N5O2/c14-8(15)7-9-1-3-12(7)5-6-13-4-2-10-11-13/h1-4H,5-6H2,(H,14,15) |
| InChIKey | InChI | 1.03 | BICABFBIPKZSEC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1nccn1CCn2ccnn2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1nccn1CCn2ccnn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cn(c(n1)C(=O)O)CCn2ccnn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cn(c(n1)C(=O)O)CCn2ccnn2 |
