QP3
Summary
| Name: | 1,3-dimethoxy-8-oxidanyl-anthracene-9,10-dione |
| Formula: | C16 H12 O5 |
| Formal charge: | 0 |
| Formula weight: | 284.263 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 1,3-dimethoxy-8-oxidanyl-anthracene-9,10-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H12O5/c1-20-8-6-10-14(12(7-8)21-2)16(19)13-9(15(10)18)4-3-5-11(13)17/h3-7,17H,1-2H3 |
| InChIKey | InChI | 1.06 | MCHNUYTWURIGNT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(OC)c2C(=O)c3c(O)cccc3C(=O)c2c1 |
| SMILES | CACTVS | 3.385 | COc1cc(OC)c2C(=O)c3c(O)cccc3C(=O)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COc1cc2c(c(c1)OC)C(=O)c3c(cccc3O)C2=O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COc1cc2c(c(c1)OC)C(=O)c3c(cccc3O)C2=O |
