M8O
Summary
| Name: | 4-Maleylacetoacetic acid |
| Formula: | C8 H8 O6 |
| Formal charge: | 0 |
| Formula weight: | 200.146 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2Z)-4,6-dioxooct-2-enedioic acid |
| OpenEye OEToolkits | 1.9.2 | 4,6-bis(oxidanylidene)oct-2-enedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(/C=C\C(=O)O)CC(=O)CC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H8O6/c9-5(1-2-7(11)12)3-6(10)4-8(13)14/h1-2H,3-4H2,(H,11,12)(H,13,14) |
| InChIKey | InChI | 1.03 | GACSIVHAIFQKTC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CC(=O)CC(=O)\C=C/C(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)CC(=O)CC(=O)C=CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C(C(=O)CC(=O)O)C(=O)C=CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C(C(=O)CC(=O)O)C(=O)C=CC(=O)O |
