[(3S)-2-oxidanylideneoxolan-3-yl] 2-methoxy-5-nitro-benzoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 2-methoxy-5-nitro-benzoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C12H11NO7 MolecularWeight: 281.21824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O[C@H]2CCOC2=O

InChI

InChI=1S/C12H11NO7/c1-18-9-3-2-7(13(16)17)6-8(9)11(14)20-10-4-5-19-12(10)15/h2-3,6,10H,4-5H2,1H3/t10-/m0/s1