IZC
Summary
| Name: | 2H-IMIDAZOL-4-YLACETIC ACID |
| Synonyms: | IMIDAZOLE-4-ACETIC ACID |
| Formula: | C5 H6 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 126.113 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2H-imidazol-4-ylacetic acid |
| OpenEye OEToolkits | 1.5.0 | 2-(2H-imidazol-4-yl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CC1=NCN=C1 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)CC1=NCN=C1 |
| SMILES | CACTVS | 3.341 | OC(=O)CC1=NCN=C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1N=CC(=N1)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1N=CC(=N1)CC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H6N2O2/c8-5(9)1-4-2-6-3-7-4/h2H,1,3H2,(H,8,9) |
| InChIKey | InChI | 1.03 | RMEAVYUMFHJQAD-UHFFFAOYSA-N |
