2-[2-(phenylmethylsulfanyl)phenyl]propanoate

Systemtic Name: 2-[2-(phenylmethylsulfanyl)phenyl]propanoate Openeye Name: 2-(2-benzylsulfanylphenyl)propanoate CAS Name: 2-[2-(phenylmethylthio)phenyl]propanoate IUPAC Name: 2-(2-benzylsulfanylphenyl)propanoate Traditional Name: 2-[2-(benzylthio)phenyl]propionate Formula: C16H15O2S- MolecularWeight: 271.3541

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1SCC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1SCC2=CC=CC=C2)C(=O)[O-]

InChI

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