(4-nitrophenyl)methyl 2-(3-bromanyl-2-oxidanylidene-azetidin-1-yl)-2-oxidanyl-ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-bromanyl-2-oxidanylidene-azetidin-1-yl)-2-oxidanyl-ethanoate Openeye Name: (4-nitrophenyl)methyl 2-(3-bromo-2-oxo-azetidin-1-yl)-2-hydroxy-acetate CAS Name: 2-(3-bromo-2-oxo-1-azetidinyl)-2-hydroxyacetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-bromo-2-oxoazetidin-1-yl)-2-hydroxyacetate Traditional Name: 2-(3-bromo-2-keto-azetidin-1-yl)-2-hydroxy-acetic acid (4-nitrobenzyl) ester Formula: C12H11BrN2O6 MolecularWeight: 359.12954

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)Br

Isomeric SMILES

C1C(C(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)Br

InChI

InChI=1S/C12H11BrN2O6/c13-9-5-14(10(9)16)11(17)12(18)21-6-7-1-3-8(4-2-7)15(19)20/h1-4,9,11,17H,5-6H2