VK3
Summary
| Name: | MENADIONE |
| Synonyms: | VITAMIN K3 2-METHYL-1,4-NAPHTHALENEDIONE |
| Formula: | C11 H8 O2 |
| Formal charge: | 0 |
| Formula weight: | 172.18 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-methylnaphthalene-1,4-dione |
| OpenEye OEToolkits | 1.5.0 | 2-methylnaphthalene-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C2c1c(cccc1)C(=O)C(=C2)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1=CC(=O)c2ccccc2C1=O |
| SMILES | CACTVS | 3.341 | CC1=CC(=O)c2ccccc2C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1=CC(=O)c2ccccc2C1=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1=CC(=O)c2ccccc2C1=O |
| InChI | InChI | 1.03 | InChI=1S/C11H8O2/c1-7-6-10(12)8-4-2-3-5-9(8)11(7)13/h2-6H,1H3 |
| InChIKey | InChI | 1.03 | MJVAVZPDRWSRRC-UHFFFAOYSA-N |
