2-(1-methylsulfanylhexoxy)-1-(3-prop-2-enylphenyl)ethanone

Systemtic Name: 2-(1-methylsulfanylhexoxy)-1-(3-prop-2-enylphenyl)ethanone Openeye Name: 1-(3-allylphenyl)-2-(1-methylsulfanylhexoxy)ethanone CAS Name: 2-[1-(methylthio)hexoxy]-1-(3-prop-2-enylphenyl)ethanone IUPAC Name: 2-(1-methylsulfanylhexoxy)-1-(3-prop-2-enylphenyl)ethanone Traditional Name: 1-(3-allylphenyl)-2-[1-(methylthio)hexoxy]ethanone Formula: C18H26O2S MolecularWeight: 306.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(OCC(=O)C1=CC(=CC=C1)CC=C)SC

Isomeric SMILES

CCCCCC(OCC(=O)C1=CC(=CC=C1)CC=C)SC

InChI

InChI=1S/C18H26O2S/c1-4-6-7-12-18(21-3)20-14-17(19)16-11-8-10-15(13-16)9-5-2/h5,8,10-11,13,18H,2,4,6-7,9,12,14H2,1,3H3