1-[3-ethyl-2-(4-methylsulfanylhexoxy)phenyl]-2-oxidanyl-ethanone

Systemtic Name: 1-[3-ethyl-2-(4-methylsulfanylhexoxy)phenyl]-2-oxidanyl-ethanone Openeye Name: 1-[3-ethyl-2-(4-methylsulfanylhexoxy)phenyl]-2-hydroxy-ethanone CAS Name: 1-[3-ethyl-2-[4-(methylthio)hexoxy]phenyl]-2-hydroxyethanone IUPAC Name: 1-[3-ethyl-2-(4-methylsulfanylhexoxy)phenyl]-2-hydroxyethanone Traditional Name: 1-[3-ethyl-2-[4-(methylthio)hexoxy]phenyl]-2-hydroxy-ethanone Formula: C17H26O3S MolecularWeight: 310.45154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1OCCCC(CC)SC)C(=O)CO

Isomeric SMILES

CCC1=CC=CC(=C1OCCCC(CC)SC)C(=O)CO

InChI

InChI=1S/C17H26O3S/c1-4-13-8-6-10-15(16(19)12-18)17(13)20-11-7-9-14(5-2)21-3/h6,8,10,14,18H,4-5,7,9,11-12H2,1-3H3