MPP
Summary
| Name: | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID |
| Formula: | C11 H14 O4 |
| Formal charge: | 0 |
| Formula weight: | 210.226 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-(3,4-dimethoxyphenyl)propanoic acid |
| OpenEye OEToolkits | 1.5.0 | 3-(3,4-dimethoxyphenyl)propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CCc1cc(OC)c(OC)cc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | COc1ccc(CCC(O)=O)cc1OC |
| SMILES | CACTVS | 3.341 | COc1ccc(CCC(O)=O)cc1OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1ccc(cc1OC)CCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | COc1ccc(cc1OC)CCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C11H14O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3,5,7H,4,6H2,1-2H3,(H,12,13) |
| InChIKey | InChI | 1.03 | LHHKQWQTBCTDQM-UHFFFAOYSA-N |
