HN9
Summary
| Name: | 1-[(4-hydroxyphenyl)methyl]imidazole-2-carboxylic acid |
| Formula: | C11 H10 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 218.209 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[(4-hydroxyphenyl)methyl]imidazole-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H10N2O3/c14-9-3-1-8(2-4-9)7-13-6-5-12-10(13)11(15)16/h1-6,14H,7H2,(H,15,16) |
| InChIKey | InChI | 1.03 | LLGCUNZOZLGRNP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(Cn2ccnc2C(O)=O)cc1 |
| SMILES | CACTVS | 3.385 | Oc1ccc(Cn2ccnc2C(O)=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1Cn2ccnc2C(=O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1Cn2ccnc2C(=O)O)O |
