(2-oxidanylideneoxolan-3-yl) 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C13H13NO8 MolecularWeight: 311.24422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC2CCOC2=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC2CCOC2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C13H13NO8/c1-19-10-5-7(8(14(17)18)6-11(10)20-2)12(15)22-9-3-4-21-13(9)16/h5-6,9H,3-4H2,1-2H3