N-[3-hexadecoxy-4-(2-methylheptan-2-yl)cyclohexa-1,3-dien-1-yl]benzenesulfonamide

Systemtic Name: N-[3-hexadecoxy-4-(2-methylheptan-2-yl)cyclohexa-1,3-dien-1-yl]benzenesulfonamide Openeye Name: N-[4-(1,1-dimethylhexyl)-3-hexadecoxy-cyclohexa-1,3-dien-1-yl]benzenesulfonamide CAS Name: N-[3-hexadecoxy-4-(2-methylheptan-2-yl)-1-cyclohexa-1,3-dienyl]benzenesulfonamide IUPAC Name: N-[3-hexadecoxy-4-(2-methylheptan-2-yl)cyclohexa-1,3-dien-1-yl]benzenesulfonamide Traditional Name: N-[3-cetyloxy-4-(1,1-dimethylhexyl)cyclohexa-1,3-dien-1-yl]benzenesulfonamide Formula: C36H61NO3S MolecularWeight: 587.93944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H61NO3S/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-24-30-40-35-31-32(37-41(38,39)33-25-21-20-22-26-33)27-28-34(35)36(3,4)29-23-8-6-2/h20-22,25-26,31,37H,5-19,23-24,27-30H2,1-4H3