N-[2,2-dimethyl-3-[(2-nitrophenyl)sulfonylamino]propyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[2,2-dimethyl-3-[(2-nitrophenyl)sulfonylamino]propyl]-2-nitro-benzenesulfonamide Openeye Name: N-[2,2-dimethyl-3-[(2-nitrophenyl)sulfonylamino]propyl]-2-nitro-benzenesulfonamide CAS Name: N-[2,2-dimethyl-3-[(2-nitrophenyl)sulfonylamino]propyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[2,2-dimethyl-3-[(2-nitrophenyl)sulfonylamino]propyl]-2-nitrobenzenesulfonamide Traditional Name: N-[2,2-dimethyl-3-[(2-nitrophenyl)sulfonylamino]propyl]-2-nitro-benzenesulfonamide Formula: C17H20N4O8S2 MolecularWeight: 472.4927

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(CNS(=O)(=O)C1=CC=CC=C1[N+](=O)[O-])CNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O8S2/c1-17(2,11-18-30(26,27)15-9-5-3-7-13(15)20(22)23)12-19-31(28,29)16-10-6-4-8-14(16)21(24)25/h3-10,18-19H,11-12H2,1-2H3