ethyl 4-methylsulfanyl-2-(3-oxidanyl-2-oxidanylidene-4-phenyl-azetidin-1-yl)butanoate

Systemtic Name: ethyl 4-methylsulfanyl-2-(3-oxidanyl-2-oxidanylidene-4-phenyl-azetidin-1-yl)butanoate Openeye Name: ethyl 2-(3-hydroxy-2-oxo-4-phenyl-azetidin-1-yl)-4-methylsulfanyl-butanoate CAS Name: 2-(3-hydroxy-2-oxo-4-phenyl-1-azetidinyl)-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-(3-hydroxy-2-oxo-4-phenylazetidin-1-yl)-4-methylsulfanylbutanoate Traditional Name: 2-(3-hydroxy-2-keto-4-phenyl-azetidin-1-yl)-4-(methylthio)butyric acid ethyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)N1C(C(C1=O)O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CCSC)N1C(C(C1=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H21NO4S/c1-3-21-16(20)12(9-10-22-2)17-13(14(18)15(17)19)11-7-5-4-6-8-11/h4-8,12-14,18H,3,9-10H2,1-2H3