UHQ
Summary
| Name: | 4-[4-(dimethylamino)piperidin-1-yl]sulfonylbenzaldehyde |
| Formula: | C14 H20 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 296.385 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-[4-(dimethylamino)piperidin-1-yl]sulfonylbenzaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H20N2O3S/c1-15(2)13-7-9-16(10-8-13)20(18,19)14-5-3-12(11-17)4-6-14/h3-6,11,13H,7-10H2,1-2H3 |
| InChIKey | InChI | 1.03 | ULLUZZQSRUXOKA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C1CCN(CC1)[S](=O)(=O)c2ccc(C=O)cc2 |
| SMILES | CACTVS | 3.385 | CN(C)C1CCN(CC1)[S](=O)(=O)c2ccc(C=O)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)C1CCN(CC1)S(=O)(=O)c2ccc(cc2)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)C1CCN(CC1)S(=O)(=O)c2ccc(cc2)C=O |
