KOH
Summary
| Name: | 3-[2-chloranyl-4-(1~{H}-imidazol-2-yl)phenoxy]propanoic acid |
| Formula: | C12 H11 Cl N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 266.68 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 3-[2-chloranyl-4-(1~{H}-imidazol-2-yl)phenoxy]propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H11ClN2O3/c13-9-7-8(12-14-4-5-15-12)1-2-10(9)18-6-3-11(16)17/h1-2,4-5,7H,3,6H2,(H,14,15)(H,16,17) |
| InChIKey | InChI | 1.03 | JDFUCVHWLSVLIA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CCOc1ccc(cc1Cl)c2[nH]ccn2 |
| SMILES | CACTVS | 3.385 | OC(=O)CCOc1ccc(cc1Cl)c2[nH]ccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1cc(c(cc1c2[nH]ccn2)Cl)OCCC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1cc(c(cc1c2[nH]ccn2)Cl)OCCC(=O)O |
