4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethoxy]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C20H22N2O8S MolecularWeight: 450.46228

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC(=O)C2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC(=O)C2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O8S/c1-3-21(4-2)31(26,27)15-6-8-18(16(12-15)22(24)25)30-13-17(23)14-5-7-19-20(11-14)29-10-9-28-19/h5-8,11-12H,3-4,9-10,13H2,1-2H3