54I
Summary
| Name: | (3E)-3-(hydroxyimino)propanoic acid |
| Formula: | C3 H5 N O3 |
| Formal charge: | 0 |
| Formula weight: | 103.077 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3E)-3-(hydroxyimino)propanoic acid |
| OpenEye OEToolkits | 2.0.7 | (3~{E})-3-hydroxyiminopropanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C\C=N\O |
| InChI | InChI | 1.03 | InChI=1S/C3H5NO3/c5-3(6)1-2-4-7/h2,7H,1H2,(H,5,6)/b4-2+ |
| InChIKey | InChI | 1.03 | XTKKYEXSKPSWOJ-DUXPYHPUSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O\N=C\CC(O)=O |
| SMILES | CACTVS | 3.385 | ON=CCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(/C=N/O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(C=NO)C(=O)O |
