1-(4-methylsulfanylphenyl)-2-(2,3,5-trimethylphenoxy)ethanone

Systemtic Name: 1-(4-methylsulfanylphenyl)-2-(2,3,5-trimethylphenoxy)ethanone Openeye Name: 1-(4-methylsulfanylphenyl)-2-(2,3,5-trimethylphenoxy)ethanone CAS Name: 1-[4-(methylthio)phenyl]-2-(2,3,5-trimethylphenoxy)ethanone IUPAC Name: 1-(4-methylsulfanylphenyl)-2-(2,3,5-trimethylphenoxy)ethanone Traditional Name: 1-[4-(methylthio)phenyl]-2-(2,3,5-trimethylphenoxy)ethanone Formula: C18H20O2S MolecularWeight: 300.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(=O)C2=CC=C(C=C2)SC)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC(=O)C2=CC=C(C=C2)SC)C)C

InChI

InChI=1S/C18H20O2S/c1-12-9-13(2)14(3)18(10-12)20-11-17(19)15-5-7-16(21-4)8-6-15/h5-10H,11H2,1-4H3