methyl 4-(3-pyridin-3-yloxypropylsulfanylmethyl)oxane-4-carboxylate

Systemtic Name: methyl 4-(3-pyridin-3-yloxypropylsulfanylmethyl)oxane-4-carboxylate Openeye Name: methyl 4-[3-(3-pyridyloxy)propylsulfanylmethyl]tetrahydropyran-4-carboxylate CAS Name: 4-[[3-(3-pyridinyloxy)propylthio]methyl]-4-oxanecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-pyridin-3-yloxypropylsulfanylmethyl)oxane-4-carboxylate Traditional Name: 4-[[3-(3-pyridyloxy)propylthio]methyl]tetrahydropyran-4-carboxylic acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCOCC1)CSCCCOC2=CN=CC=C2

Isomeric SMILES

COC(=O)C1(CCOCC1)CSCCCOC2=CN=CC=C2

InChI

InChI=1S/C16H23NO4S/c1-19-15(18)16(5-9-20-10-6-16)13-22-11-3-8-21-14-4-2-7-17-12-14/h2,4,7,12H,3,5-6,8-11,13H2,1H3