4-[[(2,4-dinitrophenyl)amino]methyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[[(2,4-dinitrophenyl)amino]methyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[(2,4-dinitroanilino)methyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[(2,4-dinitroanilino)methyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[(2,4-dinitroanilino)methyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[(2,4-dinitroanilino)methyl]-N,N-diethyl-benzenesulfonamide Formula: C17H20N4O6S MolecularWeight: 408.4289

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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)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O6S/c1-3-19(4-2)28(26,27)15-8-5-13(6-9-15)12-18-16-10-7-14(20(22)23)11-17(16)21(24)25/h5-11,18H,3-4,12H2,1-2H3