| PDB CCD ID: | UWK |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C13 H17 N O4 S |
| InChI: | InChI=1S/C13H17NO4S/c1-18-12-3-2-8-14(9-12)19(16,17)13-6-4-11(10-15)5-7-13/h4-7,10,12H,2-3,8-9H2,1H3/t12-/m1/s1 |
| InChIKey: | LBMUPTIJLJCKCH-GFCCVEGCSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | CO[C@@H]1CCCN(C1)[S](=O)(=O)c2ccc(C=O)cc2 | | OpenEye OEToolkits 2.0.7 | CO[C@@H]1CCCN(C1)S(=O)(=O)c2ccc(cc2)C=O | | CACTVS 3.385 | CO[CH]1CCCN(C1)[S](=O)(=O)c2ccc(C=O)cc2 | | OpenEye OEToolkits 2.0.7 | COC1CCCN(C1)S(=O)(=O)c2ccc(cc2)C=O |
|
| Name: | 4-[(3~{R})-3-methoxypiperidin-1-yl]sulfonylbenzaldehyde |
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