N-ethyl-5-[[3-(2-methylheptan-2-yl)phenyl]sulfonyl-octan-2-yloxy-amino]-2-octoxy-benzenesulfonamide

Systemtic Name: N-ethyl-5-[[3-(2-methylheptan-2-yl)phenyl]sulfonyl-octan-2-yloxy-amino]-2-octoxy-benzenesulfonamide Openeye Name: 5-[[3-(1,1-dimethylhexyl)phenyl]sulfonyl-(1-methylheptoxy)amino]-N-ethyl-2-octoxy-benzenesulfonamide CAS Name: N-ethyl-5-[[3-(2-methylheptan-2-yl)phenyl]sulfonyl-octan-2-yloxyamino]-2-octoxybenzenesulfonamide IUPAC Name: N-ethyl-5-[[3-(2-methylheptan-2-yl)phenyl]sulfonyl-octan-2-yloxyamino]-2-octoxybenzenesulfonamide Traditional Name: 5-[[3-(1,1-dimethylhexyl)phenyl]sulfonyl-(1-methylheptoxy)amino]-N-ethyl-2-octoxy-benzenesulfonamide Formula: C38H64N2O6S2 MolecularWeight: 709.05456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)N(OC(C)CCCCCC)S(=O)(=O)C2=CC=CC(=C2)C(C)(C)CCCCC)S(=O)(=O)NCC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)N(OC(C)CCCCCC)S(=O)(=O)C2=CC=CC(=C2)C(C)(C)CCCCC)S(=O)(=O)NCC

InChI

InChI=1S/C38H64N2O6S2/c1-8-12-15-17-18-21-29-45-36-27-26-34(31-37(36)47(41,42)39-11-4)40(46-32(5)23-19-16-13-9-2)48(43,44)35-25-22-24-33(30-35)38(6,7)28-20-14-10-3/h22,24-27,30-32,39H,8-21,23,28-29H2,1-7H3