A1AYZ
Summary
| Name: | 5-methyl-2-(trifluoromethyl)furan-3-carboxamide |
| Formula: | C7 H6 F3 N O2 |
| Formal charge: | 0 |
| Formula weight: | 193.123 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-methyl-2-(trifluoromethyl)furan-3-carboxamide |
| OpenEye OEToolkits | 2.0.7 | 5-methyl-2-(trifluoromethyl)furan-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(N)c1cc(C)oc1C(F)(F)F |
| InChI | InChI | 1.06 | InChI=1S/C7H6F3NO2/c1-3-2-4(6(11)12)5(13-3)7(8,9)10/h2H,1H3,(H2,11,12) |
| InChIKey | InChI | 1.06 | NXCKENOPYUWPSU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1oc(c(c1)C(N)=O)C(F)(F)F |
| SMILES | CACTVS | 3.385 | Cc1oc(c(c1)C(N)=O)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(o1)C(F)(F)F)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(c(o1)C(F)(F)F)C(=O)N |
