(phenylmethyl) 2-methyl-4-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 2-methyl-4-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-oxidanylidene-butanoate Openeye Name: benzyl 2-methyl-4-(2-methylsulfanyl-4-oxo-azetidin-1-yl)-3-oxo-butanoate CAS Name: 2-methyl-4-[2-(methylthio)-4-oxo-1-azetidinyl]-3-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-methyl-4-(2-methylsulfanyl-4-oxoazetidin-1-yl)-3-oxobutanoate Traditional Name: 3-keto-4-[2-keto-4-(methylthio)azetidin-1-yl]-2-methyl-butyric acid benzyl ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CN1C(CC1=O)SC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)CN1C(CC1=O)SC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO4S/c1-11(13(18)9-17-14(19)8-15(17)22-2)16(20)21-10-12-6-4-3-5-7-12/h3-7,11,15H,8-10H2,1-2H3