prop-2-ynyl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]methoxy]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]methoxy]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[[5-(4-methylsulfonylphenyl)-2-pyridyl]methoxy]piperidine-1-carboxylate CAS Name: 4-[[5-(4-methylsulfonylphenyl)-2-pyridinyl]methoxy]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]methoxy]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)-2-pyridyl]methoxy]piperidine-1-carboxylic acid propargyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)COC3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)COC3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C22H24N2O5S/c1-3-14-28-22(25)24-12-10-20(11-13-24)29-16-19-7-4-18(15-23-19)17-5-8-21(9-6-17)30(2,26)27/h1,4-9,15,20H,10-14,16H2,2H3