(2,4-dimethylphenyl) 2-methylsulfanyl-2-phenyl-ethanoate

Systemtic Name: (2,4-dimethylphenyl) 2-methylsulfanyl-2-phenyl-ethanoate Openeye Name: (2,4-dimethylphenyl) 2-methylsulfanyl-2-phenyl-acetate CAS Name: 2-(methylthio)-2-phenylacetic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 2-methylsulfanyl-2-phenylacetate Traditional Name: 2-(methylthio)-2-phenyl-acetic acid (2,4-dimethylphenyl) ester Formula: C17H18O2S MolecularWeight: 286.38862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O2S/c1-12-9-10-15(13(2)11-12)19-17(18)16(20-3)14-7-5-4-6-8-14/h4-11,16H,1-3H3