[2-(phenylmethyl)-3-sulfanyl-phenyl] ethanoate

Systemtic Name: [2-(phenylmethyl)-3-sulfanyl-phenyl] ethanoate Openeye Name: (2-benzyl-3-sulfanyl-phenyl) acetate CAS Name: acetic acid [3-mercapto-2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzyl-3-sulfanylphenyl) acetate Traditional Name: acetic acid (2-benzyl-3-mercapto-phenyl) ester Formula: C15H14O2S MolecularWeight: 258.33546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=CC=C1)S)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1=C(C(=CC=C1)S)CC2=CC=CC=C2

InChI

InChI=1S/C15H14O2S/c1-11(16)17-14-8-5-9-15(18)13(14)10-12-6-3-2-4-7-12/h2-9,18H,10H2,1H3