V2T
Summary
| Name: | 4-methanoyl-~{N}-(1-methylpyrazol-3-yl)benzamide |
| Formula: | C12 H11 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 229.235 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-methanoyl-~{N}-(1-methylpyrazol-3-yl)benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H11N3O2/c1-15-7-6-11(14-15)13-12(17)10-4-2-9(8-16)3-5-10/h2-8H,1H3,(H,13,14,17) |
| InChIKey | InChI | 1.03 | UNHIRXLYGSCEKF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1ccc(NC(=O)c2ccc(C=O)cc2)n1 |
| SMILES | CACTVS | 3.385 | Cn1ccc(NC(=O)c2ccc(C=O)cc2)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1ccc(n1)NC(=O)c2ccc(cc2)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1ccc(n1)NC(=O)c2ccc(cc2)C=O |
