methyl 2-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenoxyphenyl)butanoate

Systemtic Name: methyl 2-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenoxyphenyl)butanoate Openeye Name: methyl 2-acetylsulfanyl-4-oxo-4-(4-phenoxyphenyl)butanoate CAS Name: 2-(acetylthio)-4-oxo-4-(4-phenoxyphenyl)butanoic acid methyl ester IUPAC Name: methyl 2-acetylsulfanyl-4-oxo-4-(4-phenoxyphenyl)butanoate Traditional Name: 2-(acetylthio)-4-keto-4-(4-phenoxyphenyl)butyric acid methyl ester Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(=O)SC(CC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C19H18O5S/c1-13(20)25-18(19(22)23-2)12-17(21)14-8-10-16(11-9-14)24-15-6-4-3-5-7-15/h3-11,18H,12H2,1-2H3