N-[5-methyl-4-oxidanyl-3-(phenylsulfonyl)-2-propan-2-yl-phenyl]benzenesulfonamide

Systemtic Name: N-[5-methyl-4-oxidanyl-3-(phenylsulfonyl)-2-propan-2-yl-phenyl]benzenesulfonamide Openeye Name: N-[3-(benzenesulfonyl)-4-hydroxy-2-isopropyl-5-methyl-phenyl]benzenesulfonamide CAS Name: N-[3-(benzenesulfonyl)-4-hydroxy-5-methyl-2-propan-2-ylphenyl]benzenesulfonamide IUPAC Name: N-[3-(benzenesulfonyl)-4-hydroxy-5-methyl-2-propan-2-ylphenyl]benzenesulfonamide Traditional Name: N-(3-besyl-4-hydroxy-2-isopropyl-5-methyl-phenyl)benzenesulfonamide Formula: C22H23NO5S2 MolecularWeight: 445.55172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)S(=O)(=O)C2=CC=CC=C2)C(C)C)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1O)S(=O)(=O)C2=CC=CC=C2)C(C)C)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO5S2/c1-15(2)20-19(23-30(27,28)18-12-8-5-9-13-18)14-16(3)21(24)22(20)29(25,26)17-10-6-4-7-11-17/h4-15,23-24H,1-3H3