methyl 3-[[2-(2-methoxyoxan-4-yl)phenyl]methylsulfanyl]propanoate

Systemtic Name: methyl 3-[[2-(2-methoxyoxan-4-yl)phenyl]methylsulfanyl]propanoate Openeye Name: methyl 3-[[2-(2-methoxytetrahydropyran-4-yl)phenyl]methylsulfanyl]propanoate CAS Name: 3-[[2-(2-methoxy-4-oxanyl)phenyl]methylthio]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-methoxyoxan-4-yl)phenyl]methylsulfanyl]propanoate Traditional Name: 3-[[2-(2-methoxytetrahydropyran-4-yl)benzyl]thio]propionic acid methyl ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(CCO1)C2=CC=CC=C2CSCCC(=O)OC

Isomeric SMILES

COC1CC(CCO1)C2=CC=CC=C2CSCCC(=O)OC

InChI

InChI=1S/C17H24O4S/c1-19-16(18)8-10-22-12-14-5-3-4-6-15(14)13-7-9-21-17(11-13)20-2/h3-6,13,17H,7-12H2,1-2H3