ethyl 2-oxidanylidene-4-phenyl-3-phenylsulfanyl-butanoate

Systemtic Name: ethyl 2-oxidanylidene-4-phenyl-3-phenylsulfanyl-butanoate Openeye Name: ethyl 2-oxo-4-phenyl-3-phenylsulfanyl-butanoate CAS Name: 2-oxo-4-phenyl-3-(phenylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-oxo-4-phenyl-3-phenylsulfanylbutanoate Traditional Name: 2-keto-4-phenyl-3-(phenylthio)butyric acid ethyl ester Formula: C18H18O3S MolecularWeight: 314.39872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C(CC1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(=O)C(CC1=CC=CC=C1)SC2=CC=CC=C2

InChI

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