(4-nitrophenyl)methyl 2-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(2-methylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-methylsulfanyl-4-oxo-azetidin-1-yl)acetate CAS Name: 2-[2-(methylthio)-4-oxo-1-azetidinyl]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2-methylsulfanyl-4-oxoazetidin-1-yl)acetate Traditional Name: 2-[2-keto-4-(methylthio)azetidin-1-yl]acetic acid (4-nitrobenzyl) ester Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CC(=O)N1CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1CC(=O)N1CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O5S/c1-21-12-6-11(16)14(12)7-13(17)20-8-9-2-4-10(5-3-9)15(18)19/h2-5,12H,6-8H2,1H3