FNW
Summary
| Name: | [1-[2,4-bis(chloranyl)-3-(trifluoromethyl)phenyl]-1,2,3-triazol-4-yl]methanol |
| Formula: | C10 H6 Cl2 F3 N3 O |
| Formal charge: | 0 |
| Formula weight: | 312.075 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [1-[2,4-bis(chloranyl)-3-(trifluoromethyl)phenyl]-1,2,3-triazol-4-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H6Cl2F3N3O/c11-6-1-2-7(9(12)8(6)10(13,14)15)18-3-5(4-19)16-17-18/h1-3,19H,4H2 |
| InChIKey | InChI | 1.06 | KVIREHNULVZQCY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCc1cn(nn1)c2ccc(Cl)c(c2Cl)C(F)(F)F |
| SMILES | CACTVS | 3.385 | OCc1cn(nn1)c2ccc(Cl)c(c2Cl)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1n2cc(nn2)CO)Cl)C(F)(F)F)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1n2cc(nn2)CO)Cl)C(F)(F)F)Cl |
