N4,N4-diethyl-N1-(4-fluoranyl-3-nitro-phenyl)benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-(4-fluoranyl-3-nitro-phenyl)benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-(4-fluoro-3-nitro-phenyl)benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-(4-fluoro-3-nitrophenyl)benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-(4-fluoro-3-nitrophenyl)benzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-(4-fluoro-3-nitro-phenyl)benzene-1,4-disulfonamide Formula: C16H18FN3O6S2 MolecularWeight: 431.459023

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H18FN3O6S2/c1-3-19(4-2)28(25,26)14-8-6-13(7-9-14)27(23,24)18-12-5-10-15(17)16(11-12)20(21)22/h5-11,18H,3-4H2,1-2H3