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

Systemtic Name: N,N-diethyl-3,4-dimethyl-5-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzenesulfonamide Openeye Name: N,N-diethyl-3-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-4,5-dimethyl-benzenesulfonamide CAS Name: N,N-diethyl-3-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-4,5-dimethylbenzenesulfonamide IUPAC Name: N,N-diethyl-3-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-4,5-dimethylbenzenesulfonamide Traditional Name: N,N-diethyl-3-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-4,5-dimethyl-benzenesulfonamide Formula: C18H23N3O7S2 MolecularWeight: 457.52112

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O7S2/c1-5-20(6-2)30(27,28)15-9-12(3)13(4)16(10-15)19-29(25,26)14-7-8-18(22)17(11-14)21(23)24/h7-11,19,22H,5-6H2,1-4H3