ethyl 2-[3-(4-methylsulfanylphenyl)propanoyl]benzoate

Systemtic Name: ethyl 2-[3-(4-methylsulfanylphenyl)propanoyl]benzoate Openeye Name: ethyl 2-[3-(4-methylsulfanylphenyl)propanoyl]benzoate CAS Name: 2-[3-[4-(methylthio)phenyl]-1-oxopropyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-methylsulfanylphenyl)propanoyl]benzoate Traditional Name: 2-[3-[4-(methylthio)phenyl]propanoyl]benzoic acid ethyl ester Formula: C19H20O3S MolecularWeight: 328.4253

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1C(=O)CCC2=CC=C(C=C2)SC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1C(=O)CCC2=CC=C(C=C2)SC

InChI

InChI=1S/C19H20O3S/c1-3-22-19(21)17-7-5-4-6-16(17)18(20)13-10-14-8-11-15(23-2)12-9-14/h4-9,11-12H,3,10,13H2,1-2H3