R0M
Summary
| Name: | (2E,4E)-hepta-2,4-dienoic acid |
| Formula: | C7 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 126.153 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2E,4E)-hepta-2,4-dienoic acid |
| OpenEye OEToolkits | 2.0.7 | (2~{E},4~{E})-hepta-2,4-dienoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [C@H](\C=C\CC)=[C@H]C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h3-6H,2H2,1H3,(H,8,9)/b4-3+,6-5+ |
| InChIKey | InChI | 1.03 | GYTGOLDQGRPDNF-VNKDHWASSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC/C=C/C=C/C(O)=O |
| SMILES | CACTVS | 3.385 | CCC=CC=CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC/C=C/C=C/C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC=CC=CC(=O)O |
