HKA
Summary
| Name: | 3-METHOXY-4-PHENOXYBENZOIC ACID |
| Formula: | C14 H12 O4 |
| Formal charge: | 0 |
| Formula weight: | 244.243 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-methoxy-4-phenoxybenzoic acid |
| OpenEye OEToolkits | 1.9.2 | 3-methoxy-4-phenoxy-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c2cc(OC)c(Oc1ccccc1)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H12O4/c1-17-13-9-10(14(15)16)7-8-12(13)18-11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16) |
| InChIKey | InChI | 1.03 | BHLHNTNYVDUKFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(ccc1Oc2ccccc2)C(O)=O |
| SMILES | CACTVS | 3.385 | COc1cc(ccc1Oc2ccccc2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | COc1cc(ccc1Oc2ccccc2)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | COc1cc(ccc1Oc2ccccc2)C(=O)O |
