A1CO0
Summary
| Name: | N-[2-amino-4-(trifluoromethyl)phenyl]acetamide |
| Formula: | C9 H9 F3 N2 O |
| Formal charge: | 0 |
| Formula weight: | 218.176 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-[2-amino-4-(trifluoromethyl)phenyl]acetamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-[2-azanyl-4-(trifluoromethyl)phenyl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(C)Nc1ccc(cc1N)C(F)(F)F |
| InChI | InChI | 1.06 | InChI=1S/C9H9F3N2O/c1-5(15)14-8-3-2-6(4-7(8)13)9(10,11)12/h2-4H,13H2,1H3,(H,14,15) |
| InChIKey | InChI | 1.06 | YBCKBOPAWVBWJH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1N)C(F)(F)F |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1N)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(=O)Nc1ccc(cc1N)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(=O)Nc1ccc(cc1N)C(F)(F)F |
