2-[5-methyl-2-(phenylmethylsulfanyl)phenyl]ethanoate

Systemtic Name: 2-[5-methyl-2-(phenylmethylsulfanyl)phenyl]ethanoate Openeye Name: 2-(2-benzylsulfanyl-5-methyl-phenyl)acetate CAS Name: 2-[5-methyl-2-(phenylmethylthio)phenyl]acetate IUPAC Name: 2-(2-benzylsulfanyl-5-methylphenyl)acetate Traditional Name: 2-[2-(benzylthio)-5-methyl-phenyl]acetate Formula: C16H15O2S- MolecularWeight: 271.3541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CC=CC=C2)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CC=CC=C2)CC(=O)[O-]

InChI

InChI=1S/C16H16O2S/c1-12-7-8-15(14(9-12)10-16(17)18)19-11-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,17,18)/p-1