N,N-diethyl-4-[2-(5-fluoranyl-2-methoxy-phenyl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[2-(5-fluoranyl-2-methoxy-phenyl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[2-(5-fluoro-2-methoxy-phenyl)-2-oxo-ethoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[2-(5-fluoro-2-methoxyphenyl)-2-oxoethoxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[2-(5-fluoro-2-methoxyphenyl)-2-oxoethoxy]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[2-(5-fluoro-2-methoxy-phenyl)-2-keto-ethoxy]-3-nitro-benzenesulfonamide Formula: C19H21FN2O7S MolecularWeight: 440.442643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN2O7S/c1-4-21(5-2)30(26,27)14-7-9-19(16(11-14)22(24)25)29-12-17(23)15-10-13(20)6-8-18(15)28-3/h6-11H,4-5,12H2,1-3H3