S0P
Summary
| Name: | ~{N}-(4-cyanophenyl)ethanamide |
| Formula: | C9 H8 N2 O |
| Formal charge: | 0 |
| Formula weight: | 160.173 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(4-cyanophenyl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H8N2O/c1-7(12)11-9-4-2-8(6-10)3-5-9/h2-5H,1H3,(H,11,12) |
| InChIKey | InChI | 1.03 | UFKRTEWFEYWIHD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)C#N |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)C#N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)C#N |
