6WL
Summary
| Name: | 4-[1-methyl-7-(trifluoromethyl)indazol-3-yl]benzene-1,3-diol |
| Formula: | C15 H11 F3 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 308.255 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 4-[1-methyl-7-(trifluoromethyl)indazol-3-yl]benzene-1,3-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H11F3N2O2/c1-20-14-10(3-2-4-11(14)15(16,17)18)13(19-20)9-6-5-8(21)7-12(9)22/h2-7,21-22H,1H3 |
| InChIKey | InChI | 1.03 | GRCDZFUAPCSCFH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1nc(c2ccc(O)cc2O)c3cccc(c13)C(F)(F)F |
| SMILES | CACTVS | 3.385 | Cn1nc(c2ccc(O)cc2O)c3cccc(c13)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | Cn1c2c(cccc2C(F)(F)F)c(n1)c3ccc(cc3O)O |
| SMILES | OpenEye OEToolkits | 2.0.5 | Cn1c2c(cccc2C(F)(F)F)c(n1)c3ccc(cc3O)O |
