UQ0
Summary
| Name: | 2,3-DIMETHOXY-5-METHYL-1,4-BENZOQUINONE |
| Formula: | C9 H10 O4 |
| Formal charge: | 0 |
| Formula weight: | 182.173 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2,3-dimethoxy-5-methylcyclohexa-2,5-diene-1,4-dione |
| OpenEye OEToolkits | 1.9.2 | 2,3-dimethoxy-5-methyl-cyclohexa-2,5-diene-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1C=C(C(=O)C(OC)=C1OC)C |
| InChI | InChI | 1.03 | InChI=1S/C9H10O4/c1-5-4-6(10)8(12-2)9(13-3)7(5)11/h4H,1-3H3 |
| InChIKey | InChI | 1.03 | UIXPTCZPFCVOQF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC1=C(OC)C(=O)C(=CC1=O)C |
| SMILES | CACTVS | 3.385 | COC1=C(OC)C(=O)C(=CC1=O)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC1=CC(=O)C(=C(C1=O)OC)OC |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC1=CC(=O)C(=C(C1=O)OC)OC |
