ITN
Summary
| Name: | 2-methylidenebutanedioic acid |
| Formula: | C5 H6 O4 |
| Formal charge: | 0 |
| Formula weight: | 130.099 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 2-methylidenebutanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9) |
| InChIKey | InChI | 1.03 | LVHBHZANLOWSRM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CC(=C)C(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)CC(=C)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | C=C(CC(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.5 | C=C(CC(=O)O)C(=O)O |
