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

Systemtic Name: N-[2,6-dimethyl-4-oxidanyl-3-(phenylsulfonyl)phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(benzenesulfonyl)-4-hydroxy-2,6-dimethyl-phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[3-(benzenesulfonyl)-4-hydroxy-2,6-dimethylphenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(benzenesulfonyl)-4-hydroxy-2,6-dimethylphenyl]-4-methylbenzenesulfonamide Traditional Name: N-(3-besyl-4-hydroxy-2,6-dimethyl-phenyl)-4-methyl-benzenesulfonamide Formula: C21H21NO5S2 MolecularWeight: 431.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=C(C=C2C)O)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=C(C=C2C)O)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21NO5S2/c1-14-9-11-18(12-10-14)29(26,27)22-20-15(2)13-19(23)21(16(20)3)28(24,25)17-7-5-4-6-8-17/h4-13,22-23H,1-3H3