methyl 5-[2-(2-methoxy-5-methylsulfanyl-phenyl)ethyl]-2-oxidanyl-benzoate

Systemtic Name: methyl 5-[2-(2-methoxy-5-methylsulfanyl-phenyl)ethyl]-2-oxidanyl-benzoate Openeye Name: methyl 2-hydroxy-5-[2-(2-methoxy-5-methylsulfanyl-phenyl)ethyl]benzoate CAS Name: 2-hydroxy-5-[2-[2-methoxy-5-(methylthio)phenyl]ethyl]benzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5-[2-(2-methoxy-5-methylsulfanylphenyl)ethyl]benzoate Traditional Name: 2-hydroxy-5-[2-[2-methoxy-5-(methylthio)phenyl]ethyl]benzoic acid methyl ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SC)CCC2=CC(=C(C=C2)O)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SC)CCC2=CC(=C(C=C2)O)C(=O)OC

InChI

InChI=1S/C18H20O4S/c1-21-17-9-7-14(23-3)11-13(17)6-4-12-5-8-16(19)15(10-12)18(20)22-2/h5,7-11,19H,4,6H2,1-3H3