A1IIB
Summary
| Name: | methyl 1H-imidazole-5-carboxylate |
| Synonyms: | (4-SULFAMOYLPHENYLETHYLTHIOUREIDO)FLUORESCEIN |
| Formula: | C5 H6 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 126.113 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | methyl 1~{H}-imidazole-5-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C5H6N2O2/c1-9-5(8)4-2-6-3-7-4/h2-3H,1H3,(H,6,7) |
| InChIKey | InChI | 1.06 | DVLGIQNHKLWSRU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1[nH]cnc1 |
| SMILES | CACTVS | 3.385 | COC(=O)c1[nH]cnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)c1cnc[nH]1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)c1cnc[nH]1 |
