N-[4-(1-adamantyl)-2-methyl-5-oxidanyl-phenyl]-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-[4-(1-adamantyl)-2-methyl-5-oxidanyl-phenyl]-4-oxidanyl-benzenesulfonamide Openeye Name: N-[4-(1-adamantyl)-5-hydroxy-2-methyl-phenyl]-4-hydroxy-benzenesulfonamide CAS Name: N-[4-(1-adamantyl)-5-hydroxy-2-methylphenyl]-4-hydroxybenzenesulfonamide IUPAC Name: N-[4-(1-adamantyl)-5-hydroxy-2-methylphenyl]-4-hydroxybenzenesulfonamide Traditional Name: N-[4-(1-adamantyl)-5-hydroxy-2-methyl-phenyl]-4-hydroxy-benzenesulfonamide Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C23CC4CC(C2)CC(C4)C3)O)NS(=O)(=O)C5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(C=C(C(=C1)C23CC4CC(C2)CC(C4)C3)O)NS(=O)(=O)C5=CC=C(C=C5)O

InChI

InChI=1S/C23H27NO4S/c1-14-6-20(23-11-15-7-16(12-23)9-17(8-15)13-23)22(26)10-21(14)24-29(27,28)19-4-2-18(25)3-5-19/h2-6,10,15-17,24-26H,7-9,11-13H2,1H3