MV0
Summary
| Name: | 7-acetyl-4-methoxy-1-benzofuran-3(2H)-one |
| Formula: | C11 H10 O4 |
| Formal charge: | 0 |
| Formula weight: | 206.195 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-acetyl-4-methoxy-1-benzofuran-3(2H)-one |
| OpenEye OEToolkits | 2.0.7 | 7-ethanoyl-4-methoxy-1-benzofuran-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC(=O)c1ccc(OC)c2c1OCC2=O |
| InChI | InChI | 1.03 | InChI=1S/C11H10O4/c1-6(12)7-3-4-9(14-2)10-8(13)5-15-11(7)10/h3-4H,5H2,1-2H3 |
| InChIKey | InChI | 1.03 | NPJPMDJXSQUZBY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(C(C)=O)c2OCC(=O)c12 |
| SMILES | CACTVS | 3.385 | COc1ccc(C(C)=O)c2OCC(=O)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)c1ccc(c2c1OCC2=O)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)c1ccc(c2c1OCC2=O)OC |
