N,N-diethyl-3,4-dimethyl-5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: N,N-diethyl-3,4-dimethyl-5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzenesulfonamide Openeye Name: N,N-diethyl-3,4-dimethyl-5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzenesulfonamide CAS Name: N,N-diethyl-3,4-dimethyl-5-[(2-methyl-5-nitrophenyl)sulfonylamino]benzenesulfonamide IUPAC Name: N,N-diethyl-3,4-dimethyl-5-[(2-methyl-5-nitrophenyl)sulfonylamino]benzenesulfonamide Traditional Name: N,N-diethyl-3,4-dimethyl-5-[(2-methyl-5-nitro-phenyl)sulfonylamino]benzenesulfonamide Formula: C19H25N3O6S2 MolecularWeight: 455.5483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O6S2/c1-6-21(7-2)30(27,28)17-10-14(4)15(5)18(12-17)20-29(25,26)19-11-16(22(23)24)9-8-13(19)3/h8-12,20H,6-7H2,1-5H3