8TZ
Summary
| Name: | (~{S})-(4-fluoranyl-2-propyl-phenyl)-(1~{H}-imidazol-2-yl)methanol |
| Formula: | C13 H15 F N2 O |
| Formal charge: | 0 |
| Formula weight: | 234.269 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (~{S})-(4-fluoranyl-2-propyl-phenyl)-(1~{H}-imidazol-2-yl)methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H15FN2O/c1-2-3-9-8-10(14)4-5-11(9)12(17)13-15-6-7-16-13/h4-8,12,17H,2-3H2,1H3,(H,15,16)/t12-/m0/s1 |
| InChIKey | InChI | 1.03 | IDFPQEHZYBXIFO-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCc1cc(F)ccc1[C@H](O)c2[nH]ccn2 |
| SMILES | CACTVS | 3.385 | CCCc1cc(F)ccc1[CH](O)c2[nH]ccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCCc1cc(ccc1[C@@H](c2[nH]ccn2)O)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCCc1cc(ccc1C(c2[nH]ccn2)O)F |
