N-[2,6-dimethyl-4-oxidanyl-3-(phenylsulfonyl)phenyl]benzenesulfonamide

Systemtic Name: N-[2,6-dimethyl-4-oxidanyl-3-(phenylsulfonyl)phenyl]benzenesulfonamide Openeye Name: N-[3-(benzenesulfonyl)-4-hydroxy-2,6-dimethyl-phenyl]benzenesulfonamide CAS Name: N-[3-(benzenesulfonyl)-4-hydroxy-2,6-dimethylphenyl]benzenesulfonamide IUPAC Name: N-[3-(benzenesulfonyl)-4-hydroxy-2,6-dimethylphenyl]benzenesulfonamide Traditional Name: N-(3-besyl-4-hydroxy-2,6-dimethyl-phenyl)benzenesulfonamide Formula: C20H19NO5S2 MolecularWeight: 417.49856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1NS(=O)(=O)C2=CC=CC=C2)C)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=C(C(=C1NS(=O)(=O)C2=CC=CC=C2)C)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C20H19NO5S2/c1-14-13-18(22)20(27(23,24)16-9-5-3-6-10-16)15(2)19(14)21-28(25,26)17-11-7-4-8-12-17/h3-13,21-22H,1-2H3