YI6
Summary
| Name: | 2-(4-ethoxyphenyl)ethanoic acid |
| Formula: | C10 H12 O3 |
| Formal charge: | 0 |
| Formula weight: | 180.2 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | 2-(4-ethoxyphenyl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H12O3/c1-2-13-9-5-3-8(4-6-9)7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12) |
| InChIKey | InChI | 1.03 | ZVVWZNFSMIFGEP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOc1ccc(CC(O)=O)cc1 |
| SMILES | CACTVS | 3.385 | CCOc1ccc(CC(O)=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCOc1ccc(cc1)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCOc1ccc(cc1)CC(=O)O |
