methyl 4-methylsulfanyl-3-(oxan-4-yloxy)benzoate

Systemtic Name: methyl 4-methylsulfanyl-3-(oxan-4-yloxy)benzoate Openeye Name: methyl 4-methylsulfanyl-3-tetrahydropyran-4-yloxy-benzoate CAS Name: 4-(methylthio)-3-(4-oxanyloxy)benzoic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-3-(oxan-4-yloxy)benzoate Traditional Name: 4-(methylthio)-3-tetrahydropyran-4-yloxy-benzoic acid methyl ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)SC)OC2CCOCC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)SC)OC2CCOCC2

InChI

InChI=1S/C14H18O4S/c1-16-14(15)10-3-4-13(19-2)12(9-10)18-11-5-7-17-8-6-11/h3-4,9,11H,5-8H2,1-2H3