FUJ
Summary
| Name: | [(7-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]phosphonic acid |
| Formula: | C11 H11 O6 P |
| Formal charge: | 0 |
| Formula weight: | 270.175 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | [(7-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]phosphonic acid |
| OpenEye OEToolkits | 2.0.6 | (7-methoxy-2-oxidanylidene-chromen-4-yl)methylphosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1ccc2c(c1)OC(C=C2CP(O)(O)=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C11H11O6P/c1-16-8-2-3-9-7(6-18(13,14)15)4-11(12)17-10(9)5-8/h2-5H,6H2,1H3,(H2,13,14,15) |
| InChIKey | InChI | 1.03 | HFSBVOLOSSLWNW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2C(=CC(=O)Oc2c1)C[P](O)(O)=O |
| SMILES | CACTVS | 3.385 | COc1ccc2C(=CC(=O)Oc2c1)C[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc2c(c1)OC(=O)C=C2CP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc2c(c1)OC(=O)C=C2CP(=O)(O)O |
