A1ILE
Summary
| Name: | 1-(3,5-diethanoyl-1,3,5-triazinan-1-yl)ethanone |
| Formula: | C9 H15 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 213.234 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-(3,5-diethanoyl-1,3,5-triazinan-1-yl)ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H15N3O3/c1-7(13)10-4-11(8(2)14)6-12(5-10)9(3)15/h4-6H2,1-3H3 |
| InChIKey | InChI | 1.06 | OAQRIDXOGCNRLX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1CN(CN(C1)C(C)=O)C(C)=O |
| SMILES | CACTVS | 3.385 | CC(=O)N1CN(CN(C1)C(C)=O)C(C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CN(CN(C1)C(=O)C)C(=O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N1CN(CN(C1)C(=O)C)C(=O)C |
