N,N-diethyl-4-[[(4-fluoranyl-2-nitro-phenyl)amino]methyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[[(4-fluoranyl-2-nitro-phenyl)amino]methyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[(4-fluoro-2-nitro-anilino)methyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[(4-fluoro-2-nitroanilino)methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[(4-fluoro-2-nitroanilino)methyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[(4-fluoro-2-nitro-anilino)methyl]benzenesulfonamide Formula: C17H20FN3O4S MolecularWeight: 381.421803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H20FN3O4S/c1-3-20(4-2)26(24,25)15-8-5-13(6-9-15)12-19-16-10-7-14(18)11-17(16)21(22)23/h5-11,19H,3-4,12H2,1-2H3