(4-methoxyphenyl)methyl 4-[3-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-oxidanylidene-propyl]benzoate

Systemtic Name: (4-methoxyphenyl)methyl 4-[3-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-oxidanylidene-propyl]benzoate Openeye Name: (4-methoxyphenyl)methyl 4-[3-(2-methylsulfanyl-4-oxo-azetidin-1-yl)-2-oxo-propyl]benzoate CAS Name: 4-[3-[2-(methylthio)-4-oxo-1-azetidinyl]-2-oxopropyl]benzoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 4-[3-(2-methylsulfanyl-4-oxoazetidin-1-yl)-2-oxopropyl]benzoate Traditional Name: 4-[2-keto-3-[2-keto-4-(methylthio)azetidin-1-yl]propyl]benzoic acid p-anisyl ester Formula: C22H23NO5S MolecularWeight: 413.48672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CC(=O)CN3C(CC3=O)SC

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)CC(=O)CN3C(CC3=O)SC

InChI

InChI=1S/C22H23NO5S/c1-27-19-9-5-16(6-10-19)14-28-22(26)17-7-3-15(4-8-17)11-18(24)13-23-20(25)12-21(23)29-2/h3-10,21H,11-14H2,1-2H3