[(3S)-2-oxidanylideneoxolan-3-yl] 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C13H9NO6S MolecularWeight: 307.27866

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1OC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC(=O)[C@H]1OC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H9NO6S/c15-12-9(3-4-19-12)20-13(16)11-6-7-5-8(14(17)18)1-2-10(7)21-11/h1-2,5-6,9H,3-4H2/t9-/m0/s1