6WT
Summary
| Name: | 1-chloranyl-4-[2,2,2-tris(chloranyl)-1-(4-chlorophenyl)ethyl]benzene |
| Formula: | C14 H9 Cl5 |
| Formal charge: | 0 |
| Formula weight: | 354.486 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 1-chloranyl-4-[2,2,2-tris(chloranyl)-1-(4-chlorophenyl)ethyl]benzene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H |
| InChIKey | InChI | 1.03 | YVGGHNCTFXOJCH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl |
| SMILES | CACTVS | 3.385 | Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1cc(ccc1C(c2ccc(cc2)Cl)C(Cl)(Cl)Cl)Cl |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1cc(ccc1C(c2ccc(cc2)Cl)C(Cl)(Cl)Cl)Cl |
