N-[3-(4-chlorophenyl)sulfonyl-2,5-dimethyl-4-oxidanyl-phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfonyl-2,5-dimethyl-4-oxidanyl-phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-2,5-dimethyl-phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-2,5-dimethylphenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-2,5-dimethylphenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(4-chlorophenyl)sulfonyl-4-hydroxy-2,5-dimethyl-phenyl]-3-nitro-benzenesulfonamide Formula: C20H17ClN2O7S2 MolecularWeight: 496.94118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)S(=O)(=O)C2=CC=C(C=C2)Cl)C)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1O)S(=O)(=O)C2=CC=C(C=C2)Cl)C)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN2O7S2/c1-12-10-18(22-32(29,30)17-5-3-4-15(11-17)23(25)26)13(2)20(19(12)24)31(27,28)16-8-6-14(21)7-9-16/h3-11,22,24H,1-2H3