[4-(4-cyanophenoxy)piperidin-1-yl]sulfonylmethyl 2-ethyloxane-4-carboxylate

Systemtic Name: [4-(4-cyanophenoxy)piperidin-1-yl]sulfonylmethyl 2-ethyloxane-4-carboxylate Openeye Name: [4-(4-cyanophenoxy)-1-piperidyl]sulfonylmethyl 2-ethyltetrahydropyran-4-carboxylate CAS Name: 2-ethyl-4-oxanecarboxylic acid [4-(4-cyanophenoxy)-1-piperidinyl]sulfonylmethyl ester IUPAC Name: [4-(4-cyanophenoxy)piperidin-1-yl]sulfonylmethyl 2-ethyloxane-4-carboxylate Traditional Name: 2-ethyltetrahydropyran-4-carboxylic acid [4-(4-cyanophenoxy)piperidino]sulfonylmethyl ester Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(CCO1)C(=O)OCS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC1CC(CCO1)C(=O)OCS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)C#N

InChI

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