7T0
Summary
| Name: | 1-[2,4-bis(chloranyl)-3-(trifluoromethyl)phenyl]-1,2,3-triazole |
| Synonyms: | 1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole |
| Formula: | C9 H4 Cl2 F3 N3 |
| Formal charge: | 0 |
| Formula weight: | 282.049 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-triazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H4Cl2F3N3/c10-5-1-2-6(17-4-3-15-16-17)8(11)7(5)9(12,13)14/h1-4H |
| InChIKey | InChI | 1.03 | XVFXHCLMGYJAQI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | FC(F)(F)c1c(Cl)ccc(n2ccnn2)c1Cl |
| SMILES | CACTVS | 3.385 | FC(F)(F)c1c(Cl)ccc(n2ccnn2)c1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1n2ccnn2)Cl)C(F)(F)F)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1n2ccnn2)Cl)C(F)(F)F)Cl |
