2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]benzoate

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]benzoate Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]benzoate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]benzoate IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]benzoate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]benzoate Formula: C17H15O4S- MolecularWeight: 315.3636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C17H16O4S/c1-11(18)12-7-8-15(21-2)13(9-12)10-22-16-6-4-3-5-14(16)17(19)20/h3-9H,10H2,1-2H3,(H,19,20)/p-1