R06
Summary
| Name: | 1-[3,5-bis(2-chloranylethanoyl)-1,3,5-triazinan-1-yl]-2-chloranyl-ethanone |
| Formula: | C9 H12 Cl3 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 316.569 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 1-[3,5-bis(2-chloranylethanoyl)-1,3,5-triazinan-1-yl]-2-chloranyl-ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H12Cl3N3O3/c10-1-7(16)13-4-14(8(17)2-11)6-15(5-13)9(18)3-12/h1-6H2 |
| InChIKey | InChI | 1.06 | FIABSBGSWCLPPP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ClCC(=O)N1CN(CN(C1)C(=O)CCl)C(=O)CCl |
| SMILES | CACTVS | 3.385 | ClCC(=O)N1CN(CN(C1)C(=O)CCl)C(=O)CCl |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C1N(CN(CN1C(=O)CCl)C(=O)CCl)C(=O)CCl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | C1N(CN(CN1C(=O)CCl)C(=O)CCl)C(=O)CCl |
