N,N-dibutyl-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: N,N-dibutyl-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide Openeye Name: N,N-dibutyl-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide CAS Name: N,N-dibutyl-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide IUPAC Name: N,N-dibutyl-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide Traditional Name: N,N-dibutyl-4-(nosylamino)benzenesulfonamide Formula: C20H27N3O6S2 MolecularWeight: 469.57488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O6S2/c1-3-5-15-22(16-6-4-2)31(28,29)20-11-7-17(8-12-20)21-30(26,27)19-13-9-18(10-14-19)23(24)25/h7-14,21H,3-6,15-16H2,1-2H3