N86
Summary
| Name: | ~{N}-quinolin-7-ylprop-2-enamide |
| Formula: | C12 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 198.221 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-quinolin-7-ylprop-2-enamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H10N2O/c1-2-12(15)14-10-6-5-9-4-3-7-13-11(9)8-10/h2-8H,1H2,(H,14,15) |
| InChIKey | InChI | 1.06 | HUCVNAKJPDEIAX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C=CC(=O)Nc1ccc2cccnc2c1 |
| SMILES | CACTVS | 3.385 | C=CC(=O)Nc1ccc2cccnc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C=CC(=O)Nc1ccc2cccnc2c1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | C=CC(=O)Nc1ccc2cccnc2c1 |
