MUX
Summary
| Name: | (4-methyl-2-oxidanylidene-chromen-7-yl) hydrogen sulfate |
| Formula: | C10 H8 O6 S |
| Formal charge: | 0 |
| Formula weight: | 256.232 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-methyl-2-oxo-2H-chromen-7-yl hydrogen sulfate |
| OpenEye OEToolkits | 1.9.2 | (4-methyl-2-oxidanylidene-chromen-7-yl) hydrogen sulfate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(O)Oc2ccc1c(OC(=O)C=C1C)c2 |
| InChI | InChI | 1.03 | InChI=1S/C10H8O6S/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14/h2-5H,1H3,(H,12,13,14) |
| InChIKey | InChI | 1.03 | FUYLLJCBCKRIAL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=CC(=O)Oc2cc(O[S](O)(=O)=O)ccc12 |
| SMILES | CACTVS | 3.385 | CC1=CC(=O)Oc2cc(O[S](O)(=O)=O)ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC1=CC(=O)Oc2c1ccc(c2)OS(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC1=CC(=O)Oc2c1ccc(c2)OS(=O)(=O)O |
