U9W
Summary
| Name: | ~{N}-(4-chlorophenyl)-4-methyl-piperidine-1-carboxamide |
| Formula: | C13 H17 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 252.74 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(4-chlorophenyl)-4-methyl-piperidine-1-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H17ClN2O/c1-10-6-8-16(9-7-10)13(17)15-12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3,(H,15,17) |
| InChIKey | InChI | 1.03 | WMWBLCFXKIUSDK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1CCN(CC1)C(=O)Nc2ccc(Cl)cc2 |
| SMILES | CACTVS | 3.385 | CC1CCN(CC1)C(=O)Nc2ccc(Cl)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1CCN(CC1)C(=O)Nc2ccc(cc2)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CCN(CC1)C(=O)Nc2ccc(cc2)Cl |
