A1IJM
Summary
| Name: | 2-[4-[(3~{R})-2,6-bis(oxidanylidene)piperidin-3-yl]phenoxy]-~{N}-methyl-ethanamide |
| Formula: | C14 H16 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 276.288 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[4-[(3~{R})-2,6-bis(oxidanylidene)piperidin-3-yl]phenoxy]-~{N}-methyl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H16N2O4/c1-15-13(18)8-20-10-4-2-9(3-5-10)11-6-7-12(17)16-14(11)19/h2-5,11H,6-8H2,1H3,(H,15,18)(H,16,17,19)/t11-/m1/s1 |
| InChIKey | InChI | 1.06 | XHRWBMHYHBGQDM-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)COc1ccc(cc1)[C@H]2CCC(=O)NC2=O |
| SMILES | CACTVS | 3.385 | CNC(=O)COc1ccc(cc1)[CH]2CCC(=O)NC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNC(=O)COc1ccc(cc1)[C@H]2CCC(=O)NC2=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNC(=O)COc1ccc(cc1)C2CCC(=O)NC2=O |
