ethyl 2-(ethanoylsulfanylmethyl)-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: ethyl 2-(ethanoylsulfanylmethyl)-4-oxidanylidene-4-phenyl-butanoate Openeye Name: ethyl 2-(acetylsulfanylmethyl)-4-oxo-4-phenyl-butanoate CAS Name: 2-[(acetylthio)methyl]-4-oxo-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-(acetylsulfanylmethyl)-4-oxo-4-phenylbutanoate Traditional Name: 2-[(acetylthio)methyl]-4-keto-4-phenyl-butyric acid ethyl ester Formula: C15H18O4S MolecularWeight: 294.36602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=CC=C1)CSC(=O)C

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC=CC=C1)CSC(=O)C

InChI

InChI=1S/C15H18O4S/c1-3-19-15(18)13(10-20-11(2)16)9-14(17)12-7-5-4-6-8-12/h4-8,13H,3,9-10H2,1-2H3