methyl 2-(2-hydroxyphenyl)sulfanyloctanoate

Systemtic Name: methyl 2-(2-hydroxyphenyl)sulfanyloctanoate Openeye Name: methyl 2-(2-hydroxyphenyl)sulfanyloctanoate CAS Name: 2-[(2-hydroxyphenyl)thio]octanoic acid methyl ester IUPAC Name: methyl 2-(2-hydroxyphenyl)sulfanyloctanoate Traditional Name: 2-[(2-hydroxyphenyl)thio]caprylic acid methyl ester Formula: C15H22O3S MolecularWeight: 282.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC)SC1=CC=CC=C1O

Isomeric SMILES

CCCCCCC(C(=O)OC)SC1=CC=CC=C1O

InChI

InChI=1S/C15H22O3S/c1-3-4-5-6-11-14(15(17)18-2)19-13-10-8-7-9-12(13)16/h7-10,14,16H,3-6,11H2,1-2H3