(2-ethenyl-2-methyl-4-oxidanylidene-azetidin-3-yl)methyl 2-(4-nitrophenyl)ethaneperoxoate

Systemtic Name: (2-ethenyl-2-methyl-4-oxidanylidene-azetidin-3-yl)methyl 2-(4-nitrophenyl)ethaneperoxoate Openeye Name: (2-methyl-4-oxo-2-vinyl-azetidin-3-yl)methyl 2-(4-nitrophenyl)peroxyacetate CAS Name: 2-(4-nitrophenyl)ethaneperoxoic acid (2-ethenyl-2-methyl-4-oxo-3-azetidinyl)methyl ester IUPAC Name: (2-ethenyl-2-methyl-4-oxoazetidin-3-yl)methyl 2-(4-nitrophenyl)ethaneperoxoate Traditional Name: 2-(4-nitrophenyl)peracetic acid (4-keto-2-methyl-2-vinyl-azetidin-3-yl)methyl ester Formula: C15H16N2O6 MolecularWeight: 320.29734

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)N1)COOC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C=C

Isomeric SMILES

CC1(C(C(=O)N1)COOC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C=C

InChI

InChI=1S/C15H16N2O6/c1-3-15(2)12(14(19)16-15)9-22-23-13(18)8-10-4-6-11(7-5-10)17(20)21/h3-7,12H,1,8-9H2,2H3,(H,16,19)