QON
Summary
| Name: | N-[1-(2-Chloroacetyl)piperidin-4-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide |
| Synonyms: | ~{N}-[1-(2-chloranylethanoyl)piperidin-4-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide |
| Formula: | C14 H18 Cl N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 311.764 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[1-(2-chloranylethanoyl)piperidin-4-yl]-5-cyclopropyl-1,2-oxazole-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H18ClN3O3/c15-8-13(19)18-5-3-10(4-6-18)16-14(20)11-7-12(21-17-11)9-1-2-9/h7,9-10H,1-6,8H2,(H,16,20) |
| InChIKey | InChI | 1.03 | OENTXAYVUCLRJQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ClCC(=O)N1CCC(CC1)NC(=O)c2cc(on2)C3CC3 |
| SMILES | CACTVS | 3.385 | ClCC(=O)N1CCC(CC1)NC(=O)c2cc(on2)C3CC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(onc1C(=O)NC2CCN(CC2)C(=O)CCl)C3CC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(onc1C(=O)NC2CCN(CC2)C(=O)CCl)C3CC3 |
