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

Systemtic Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-4-oxidanylidene-azetidin-1-yl)ethanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-4-oxo-azetidin-1-yl)acetate CAS Name: 2-[2-(tert-butylthio)-4-oxo-1-azetidinyl]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-4-oxoazetidin-1-yl)acetate Traditional Name: 2-[2-(tert-butylthio)-4-keto-azetidin-1-yl]acetic acid (4-nitrobenzyl) ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1CC(=O)N1CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)SC1CC(=O)N1CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O5S/c1-16(2,3)24-14-8-13(19)17(14)9-15(20)23-10-11-4-6-12(7-5-11)18(21)22/h4-7,14H,8-10H2,1-3H3