HWC
Summary
| Name: | 3-azanyl-5-bromanyl-1-methyl-pyridin-2-one |
| Formula: | C6 H7 Br N2 O |
| Formal charge: | 0 |
| Formula weight: | 203.037 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-azanyl-5-bromanyl-1-methyl-pyridin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H7BrN2O/c1-9-3-4(7)2-5(8)6(9)10/h2-3H,8H2,1H3 |
| InChIKey | InChI | 1.06 | KRUDZWOELKQDJW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C=C(Br)C=C(N)C1=O |
| SMILES | CACTVS | 3.385 | CN1C=C(Br)C=C(N)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1C=C(C=C(C1=O)N)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN1C=C(C=C(C1=O)N)Br |
