N-[3,5-bis-(4-methylphenyl)sulfonyl-4-oxidanyl-phenyl]-4-chloranyl-benzenesulfonamide

Systemtic Name: N-[3,5-bis-(4-methylphenyl)sulfonyl-4-oxidanyl-phenyl]-4-chloranyl-benzenesulfonamide Openeye Name: 4-chloro-N-[4-hydroxy-3,5-bis(p-tolylsulfonyl)phenyl]benzenesulfonamide CAS Name: 4-chloro-N-[4-hydroxy-3,5-bis-(4-methylphenyl)sulfonylphenyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[4-hydroxy-3,5-bis-(4-methylphenyl)sulfonylphenyl]benzenesulfonamide Traditional Name: 4-chloro-N-(4-hydroxy-3,5-ditosyl-phenyl)benzenesulfonamide Formula: C26H22ClNO7S3 MolecularWeight: 592.10338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC(=C2O)S(=O)(=O)C3=CC=C(C=C3)C)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC(=C2O)S(=O)(=O)C3=CC=C(C=C3)C)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H22ClNO7S3/c1-17-3-9-21(10-4-17)36(30,31)24-15-20(28-38(34,35)23-13-7-19(27)8-14-23)16-25(26(24)29)37(32,33)22-11-5-18(2)6-12-22/h3-16,28-29H,1-2H3