methyl 3-(2-ethanoyl-3-phenyl-phenyl)sulfanylpropanoate

Systemtic Name: methyl 3-(2-ethanoyl-3-phenyl-phenyl)sulfanylpropanoate Openeye Name: methyl 3-(2-acetyl-3-phenyl-phenyl)sulfanylpropanoate CAS Name: 3-[(2-acetyl-3-phenylphenyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(2-acetyl-3-phenylphenyl)sulfanylpropanoate Traditional Name: 3-[(2-acetyl-3-phenyl-phenyl)thio]propionic acid methyl ester Formula: C18H18O3S MolecularWeight: 314.39872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC=C1SCCC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=C(C=CC=C1SCCC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C18H18O3S/c1-13(19)18-15(14-7-4-3-5-8-14)9-6-10-16(18)22-12-11-17(20)21-2/h3-10H,11-12H2,1-2H3