MYT
Summary
| Name: | METYRAPONE |
| Formula: | C14 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 226.274 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-methyl-1,2-dipyridin-3-ylpropan-1-one |
| OpenEye OEToolkits | 1.5.0 | 2-methyl-1,2-dipyridin-3-yl-propan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c1cccnc1)C(c2cccnc2)(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)(c1cccnc1)C(=O)c2cccnc2 |
| SMILES | CACTVS | 3.341 | CC(C)(c1cccnc1)C(=O)c2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)(c1cccnc1)C(=O)c2cccnc2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)(c1cccnc1)C(=O)c2cccnc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3 |
| InChIKey | InChI | 1.03 | FJLBFSROUSIWMA-UHFFFAOYSA-N |
