MYO
Summary
| Name: | 4-azanyl-1~{H}-pyrazole-3,5-dicarboxylic acid |
| Formula: | C5 H5 N3 O4 |
| Formal charge: | 0 |
| Formula weight: | 171.111 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-azanyl-1~{H}-pyrazole-3,5-dicarboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C5H5N3O4/c6-1-2(4(9)10)7-8-3(1)5(11)12/h6H2,(H,7,8)(H,9,10)(H,11,12) |
| InChIKey | InChI | 1.06 | IGUCGPRNZVGVNO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1c([nH]nc1C(O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | Nc1c([nH]nc1C(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1(c([nH]nc1C(=O)O)C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1(c([nH]nc1C(=O)O)C(=O)O)N |
