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

Systemtic Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxidanylidene-azetidin-1-yl)-4,4-dimethyl-3-oxidanylidene-pentanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxo-azetidin-1-yl)-4,4-dimethyl-3-oxo-pentanoate CAS Name: 2-[2-(tert-butylthio)-3,3-dimethyl-4-oxo-1-azetidinyl]-4,4-dimethyl-3-oxopentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2-tert-butylsulfanyl-3,3-dimethyl-4-oxoazetidin-1-yl)-4,4-dimethyl-3-oxopentanoate Traditional Name: 2-[2-(tert-butylthio)-4-keto-3,3-dimethyl-azetidin-1-yl]-3-keto-4,4-dimethyl-valeric acid (4-nitrobenzyl) ester Formula: C23H32N2O6S MolecularWeight: 464.57498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O6S/c1-21(2,3)17(26)16(24-19(28)23(7,8)20(24)32-22(4,5)6)18(27)31-13-14-9-11-15(12-10-14)25(29)30/h9-12,16,20H,13H2,1-8H3