PJ7
Summary
| Name: | 4-aminofuran-2-carboxylic acid |
| Formula: | C5 H5 N O3 |
| Formal charge: | 0 |
| Formula weight: | 127.098 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-aminofuran-2-carboxylic acid |
| OpenEye OEToolkits | 1.7.0 | 4-azanylfuran-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c1occ(N)c1 |
| SMILES_CANONICAL | CACTVS | 3.370 | Nc1coc(c1)C(O)=O |
| SMILES | CACTVS | 3.370 | Nc1coc(c1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1c(coc1C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1c(coc1C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H5NO3/c6-3-1-4(5(7)8)9-2-3/h1-2H,6H2,(H,7,8) |
| InChIKey | InChI | 1.03 | JZMYAVSMLZDPMH-UHFFFAOYSA-N |
