8MK
Summary
| Name: | (~{E})-4-(4-hydroxyphenyl)but-3-en-2-one |
| Formula: | C10 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 162.185 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (~{E})-4-(4-hydroxyphenyl)but-3-en-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H10O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h2-7,12H,1H3/b3-2+ |
| InChIKey | InChI | 1.03 | OCNIKEFATSKIBE-NSCUHMNNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)\C=C\c1ccc(O)cc1 |
| SMILES | CACTVS | 3.385 | CC(=O)C=Cc1ccc(O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)/C=C/c1ccc(cc1)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)C=Cc1ccc(cc1)O |
