ethyl 4-[[4-(4-cyanophenoxy)piperidin-1-yl]sulfonylmethyl]oxane-4-carboxylate

Systemtic Name: ethyl 4-[[4-(4-cyanophenoxy)piperidin-1-yl]sulfonylmethyl]oxane-4-carboxylate Openeye Name: ethyl 4-[[4-(4-cyanophenoxy)-1-piperidyl]sulfonylmethyl]tetrahydropyran-4-carboxylate CAS Name: 4-[[4-(4-cyanophenoxy)-1-piperidinyl]sulfonylmethyl]-4-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-cyanophenoxy)piperidin-1-yl]sulfonylmethyl]oxane-4-carboxylate Traditional Name: 4-[[4-(4-cyanophenoxy)piperidino]sulfonylmethyl]tetrahydropyran-4-carboxylic acid ethyl ester Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCOCC1)CS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)C1(CCOCC1)CS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H28N2O6S/c1-2-28-20(24)21(9-13-27-14-10-21)16-30(25,26)23-11-7-19(8-12-23)29-18-5-3-17(15-22)4-6-18/h3-6,19H,2,7-14,16H2,1H3