UWH
Summary
| Name: | 4-[4-(2-methoxyethyl)piperazin-1-yl]sulfonylbenzaldehyde |
| Formula: | C14 H20 N2 O4 S |
| Formal charge: | 0 |
| Formula weight: | 312.385 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-[4-(2-methoxyethyl)piperazin-1-yl]sulfonylbenzaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H20N2O4S/c1-20-11-10-15-6-8-16(9-7-15)21(18,19)14-4-2-13(12-17)3-5-14/h2-5,12H,6-11H2,1H3 |
| InChIKey | InChI | 1.03 | BLJXFQSWMIPUOV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCCN1CCN(CC1)[S](=O)(=O)c2ccc(C=O)cc2 |
| SMILES | CACTVS | 3.385 | COCCN1CCN(CC1)[S](=O)(=O)c2ccc(C=O)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COCCN1CCN(CC1)S(=O)(=O)c2ccc(cc2)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COCCN1CCN(CC1)S(=O)(=O)c2ccc(cc2)C=O |
