[(3S)-2-oxidanylideneoxolan-3-yl] 5-ethoxy-4-methoxy-2-nitro-benzoate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C14H15NO8 MolecularWeight: 325.2708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OC2CCOC2=O)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)O[C@H]2CCOC2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C14H15NO8/c1-3-21-12-6-8(9(15(18)19)7-11(12)20-2)13(16)23-10-4-5-22-14(10)17/h6-7,10H,3-5H2,1-2H3/t10-/m0/s1