OXP
Summary
| Name: | 2-OXO-3-PENTENOIC ACID |
| Formula: | C5 H6 O3 |
| Formal charge: | 0 |
| Formula weight: | 114.099 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (3Z)-2-oxopent-3-enoic acid |
| OpenEye OEToolkits | 1.5.0 | (Z)-2-oxopent-3-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(\C=C/C)C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | C\C=C/C(=O)C(O)=O |
| SMILES | CACTVS | 3.341 | CC=CC(=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C\C=C/C(=O)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC=CC(=O)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H6O3/c1-2-3-4(6)5(7)8/h2-3H,1H3,(H,7,8)/b3-2- |
| InChIKey | InChI | 1.03 | IWARWSDDJHGZOW-IHWYPQMZSA-N |
