JIK
Summary
| Name: | 1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxylic acid |
| Formula: | C12 H13 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 231.251 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H13N3O2/c16-12(17)9-5-8-7-14-15(11(8)13-6-9)10-3-1-2-4-10/h5-7,10H,1-4H2,(H,16,17) |
| InChIKey | InChI | 1.06 | OJOATUNPRXJFJJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cnc2n(ncc2c1)C3CCCC3 |
| SMILES | CACTVS | 3.385 | OC(=O)c1cnc2n(ncc2c1)C3CCCC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c2cnn(c2ncc1C(=O)O)C3CCCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c2cnn(c2ncc1C(=O)O)C3CCCC3 |
