N-[[3-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]phenyl]methyl]methanesulfonamide

Systemtic Name: N-[[3-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]phenyl]methyl]methanesulfonamide Openeye Name: N-[[3-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]phenyl]methyl]methanesulfonamide CAS Name: N-[[3-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]phenyl]methyl]methanesulfonamide IUPAC Name: N-[[3-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]phenyl]methyl]methanesulfonamide Traditional Name: N-[3-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]benzyl]methanesulfonamide Formula: C23H33NO3S MolecularWeight: 403.57802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CC(=CC=C2)CNS(=O)(=O)C)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CC(=CC=C2)CNS(=O)(=O)C)O

InChI

InChI=1S/C23H33NO3S/c1-5-6-7-8-14-23(2,3)20-12-13-21(22(25)16-20)19-11-9-10-18(15-19)17-24-28(4,26)27/h9-13,15-16,24-25H,5-8,14,17H2,1-4H3