N,N-diethyl-3-nitro-4-[(3S)-2-oxidanylideneoxolan-3-yl]oxy-benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[(3S)-2-oxidanylideneoxolan-3-yl]oxy-benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[(3S)-2-oxotetrahydrofuran-3-yl]oxy-benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[[(3S)-2-oxo-3-oxolanyl]oxy]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[(3S)-2-oxooxolan-3-yl]oxybenzenesulfonamide Traditional Name: N,N-diethyl-4-[(3S)-2-ketotetrahydrofuran-3-yl]oxy-3-nitro-benzenesulfonamide Formula: C14H18N2O7S MolecularWeight: 358.36692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2CCOC2=O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O[C@H]2CCOC2=O)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O7S/c1-3-15(4-2)24(20,21)10-5-6-12(11(9-10)16(18)19)23-13-7-8-22-14(13)17/h5-6,9,13H,3-4,7-8H2,1-2H3/t13-/m0/s1