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Summary
| Name: | {4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridin-2-yl}methanol |
| Formula: | C15 H12 F N3 O |
| Formal charge: | 0 |
| Formula weight: | 269.274 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | {4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridin-2-yl}methanol |
| OpenEye OEToolkits | 1.7.6 | [4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridin-2-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc3ccc(c1nncc1c2ccnc(c2)CO)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H12FN3O/c16-12-3-1-10(2-4-12)15-14(8-18-19-15)11-5-6-17-13(7-11)9-20/h1-8,20H,9H2,(H,18,19) |
| InChIKey | InChI | 1.03 | RKBVIYAYFDBXIL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OCc1cc(ccn1)c2c[nH]nc2c3ccc(F)cc3 |
| SMILES | CACTVS | 3.370 | OCc1cc(ccn1)c2c[nH]nc2c3ccc(F)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2c(c[nH]n2)c3ccnc(c3)CO)F |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2c(c[nH]n2)c3ccnc(c3)CO)F |
