N-[3-hexadecoxy-6-oxidanyl-2-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonamide

Systemtic Name: N-[3-hexadecoxy-6-oxidanyl-2-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonamide Openeye Name: N-[3-hexadecoxy-6-hydroxy-2-(1,1,3,3-tetramethylbutyl)phenyl]benzenesulfonamide CAS Name: N-[3-hexadecoxy-6-hydroxy-2-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonamide IUPAC Name: N-[3-hexadecoxy-6-hydroxy-2-(2,4,4-trimethylpentan-2-yl)phenyl]benzenesulfonamide Traditional Name: N-[3-cetyloxy-6-hydroxy-2-(1,1,3,3-tetramethylbutyl)phenyl]benzenesulfonamide Formula: C36H59NO4S MolecularWeight: 601.92296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C(=C(C=C1)O)NS(=O)(=O)C2=CC=CC=C2)C(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C(=C(C=C1)O)NS(=O)(=O)C2=CC=CC=C2)C(C)(C)CC(C)(C)C

InChI

InChI=1S/C36H59NO4S/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-28-41-32-27-26-31(38)34(33(32)36(5,6)29-35(2,3)4)37-42(39,40)30-24-21-20-22-25-30/h20-22,24-27,37-38H,7-19,23,28-29H2,1-6H3