U8X
Summary
| Name: | ~{N}-(4-hydroxyphenyl)-2-pyrazol-1-yl-ethanamide |
| Formula: | C11 H11 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 217.224 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(4-hydroxyphenyl)-2-pyrazol-1-yl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C11H11N3O2/c15-10-4-2-9(3-5-10)13-11(16)8-14-7-1-6-12-14/h1-7,15H,8H2,(H,13,16) |
| InChIKey | InChI | 1.06 | BSUVSWPKCMWXTE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(NC(=O)Cn2cccn2)cc1 |
| SMILES | CACTVS | 3.385 | Oc1ccc(NC(=O)Cn2cccn2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cnn(c1)CC(=O)Nc2ccc(cc2)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cnn(c1)CC(=O)Nc2ccc(cc2)O |
