N-cyclohexa-1,3-dien-1-yl-5-(2-methylheptan-2-yl)-2-octoxy-benzenesulfonamide

Systemtic Name: N-cyclohexa-1,3-dien-1-yl-5-(2-methylheptan-2-yl)-2-octoxy-benzenesulfonamide Openeye Name: N-cyclohexa-1,3-dien-1-yl-5-(1,1-dimethylhexyl)-2-octoxy-benzenesulfonamide CAS Name: N-(1-cyclohexa-1,3-dienyl)-5-(2-methylheptan-2-yl)-2-octoxybenzenesulfonamide IUPAC Name: N-cyclohexa-1,3-dien-1-yl-5-(2-methylheptan-2-yl)-2-octoxybenzenesulfonamide Traditional Name: N-cyclohexa-1,3-dien-1-yl-5-(1,1-dimethylhexyl)-2-octoxy-benzenesulfonamide Formula: C28H45NO3S MolecularWeight: 475.7268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(C)(C)CCCCC)S(=O)(=O)NC2=CC=CCC2

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(C)(C)CCCCC)S(=O)(=O)NC2=CC=CCC2

InChI

InChI=1S/C28H45NO3S/c1-5-7-9-10-11-16-22-32-26-20-19-24(28(3,4)21-15-8-6-2)23-27(26)33(30,31)29-25-17-13-12-14-18-25/h12-13,17,19-20,23,29H,5-11,14-16,18,21-22H2,1-4H3