A1C6S
Summary
| Name: | (2Z)-4-hydroxypenta-2,4-dienal |
| Formula: | C5 H6 O2 |
| Formal charge: | 0 |
| Formula weight: | 98.1 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (2Z)-4-hydroxypenta-2,4-dienal |
| OpenEye OEToolkits | 3.1.0.0 | (2~{Z})-4-oxidanylpenta-2,4-dienal |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | C=C(O)/C=C\C=O |
| InChI | InChI | 1.06 | InChI=1S/C5H6O2/c1-5(7)3-2-4-6/h2-4,7H,1H2/b3-2- |
| InChIKey | InChI | 1.06 | NWHPNPYFSMOLIQ-IHWYPQMZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=C)\C=C/C=O |
| SMILES | CACTVS | 3.385 | OC(=C)C=CC=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C=C(/C=C\C=O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | C=C(C=CC=O)O |
