(4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxidanylidene-azetidin-1-yl)ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxidanylidene-azetidin-1-yl)ethanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxo-azetidin-1-yl)acetate CAS Name: 2-[2-(tert-butylthio)-3,3-dimethyl-4-oxo-1-azetidinyl]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxoazetidin-1-yl)acetate Traditional Name: 2-[2-(tert-butylthio)-4-keto-3,3-dimethyl-azetidin-1-yl]acetic acid (4-nitrobenzyl) ester Formula: C18H24N2O5S MolecularWeight: 380.45856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C1=O)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(C)(C)C)C

Isomeric SMILES

CC1(C(N(C1=O)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC(C)(C)C)C

InChI

InChI=1S/C18H24N2O5S/c1-17(2,3)26-16-18(4,5)15(22)19(16)10-14(21)25-11-12-6-8-13(9-7-12)20(23)24/h6-9,16H,10-11H2,1-5H3