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

Systemtic Name: ethyl 2-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenoxyphenyl)butanoate Openeye Name: ethyl 2-acetylsulfanyl-4-oxo-4-(4-phenoxyphenyl)butanoate CAS Name: 2-(acetylthio)-4-oxo-4-(4-phenoxyphenyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-acetylsulfanyl-4-oxo-4-(4-phenoxyphenyl)butanoate Traditional Name: 2-(acetylthio)-4-keto-4-(4-phenoxyphenyl)butyric acid ethyl ester Formula: C20H20O5S MolecularWeight: 372.4348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20O5S/c1-3-24-20(23)19(26-14(2)21)13-18(22)15-9-11-17(12-10-15)25-16-7-5-4-6-8-16/h4-12,19H,3,13H2,1-2H3