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

Systemtic Name: N,N-diethyl-2-methyl-5-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzenesulfonamide Openeye Name: N,N-diethyl-5-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-2-methyl-benzenesulfonamide CAS Name: N,N-diethyl-5-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-2-methylbenzenesulfonamide IUPAC Name: N,N-diethyl-5-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-2-methylbenzenesulfonamide Traditional Name: N,N-diethyl-5-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-2-methyl-benzenesulfonamide Formula: C17H21N3O7S2 MolecularWeight: 443.49454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O7S2/c1-4-19(5-2)29(26,27)17-10-13(7-6-12(17)3)18-28(24,25)14-8-9-16(21)15(11-14)20(22)23/h6-11,18,21H,4-5H2,1-3H3