methyl 2-[3-(4-hydroxyphenyl)sulfanyl-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 2-[3-(4-hydroxyphenyl)sulfanyl-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 2-[2-hydroxy-3-(4-hydroxyphenyl)sulfanyl-propoxy]benzoate CAS Name: 2-[2-hydroxy-3-[(4-hydroxyphenyl)thio]propoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[2-hydroxy-3-(4-hydroxyphenyl)sulfanylpropoxy]benzoate Traditional Name: 2-[2-hydroxy-3-[(4-hydroxyphenyl)thio]propoxy]benzoic acid methyl ester Formula: C17H18O5S MolecularWeight: 334.38682

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OCC(CSC2=CC=C(C=C2)O)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1OCC(CSC2=CC=C(C=C2)O)O

InChI

InChI=1S/C17H18O5S/c1-21-17(20)15-4-2-3-5-16(15)22-10-13(19)11-23-14-8-6-12(18)7-9-14/h2-9,13,18-19H,10-11H2,1H3