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

Systemtic Name: 3-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-N,N-diethyl-4-methyl-benzenesulfonamide Openeye Name: 3-[(2-chloro-5-nitro-phenyl)sulfonylamino]-N,N-diethyl-4-methyl-benzenesulfonamide CAS Name: 3-[(2-chloro-5-nitrophenyl)sulfonylamino]-N,N-diethyl-4-methylbenzenesulfonamide IUPAC Name: 3-[(2-chloro-5-nitrophenyl)sulfonylamino]-N,N-diethyl-4-methylbenzenesulfonamide Traditional Name: 3-[(2-chloro-5-nitro-phenyl)sulfonylamino]-N,N-diethyl-4-methyl-benzenesulfonamide Formula: C17H20ClN3O6S2 MolecularWeight: 461.9402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN3O6S2/c1-4-20(5-2)29(26,27)14-8-6-12(3)16(11-14)19-28(24,25)17-10-13(21(22)23)7-9-15(17)18/h6-11,19H,4-5H2,1-3H3