GZP
Summary
| Name: | 1-(3-PHENYL-1H-PYRAZOL-5-YL)CYCLOPENTANOL |
| Formula: | C14 H16 N2 O |
| Formal charge: | 0 |
| Formula weight: | 228.29 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 1-(5-phenyl-1H-pyrazol-3-yl)cyclopentan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H16N2O/c17-14(8-4-5-9-14)13-10-12(15-16-13)11-6-2-1-3-7-11/h1-3,6-7,10,17H,4-5,8-9H2,(H,15,16) |
| InChIKey | InChI | 1.03 | GKHXBOMLCZWNOE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC1(CCCC1)c2cc([nH]n2)c3ccccc3 |
| SMILES | CACTVS | 3.385 | OC1(CCCC1)c2cc([nH]n2)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)c2cc(n[nH]2)C3(CCCC3)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)c2cc(n[nH]2)C3(CCCC3)O |
