2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-chloranyl-4-[2,2,3,3,4,4,5,5-octakis(fluoranyl)pentanoylamino]-5-oxidanyl-phenyl]hexanamide

Systemtic Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-chloranyl-4-[2,2,3,3,4,4,5,5-octakis(fluoranyl)pentanoylamino]-5-oxidanyl-phenyl]hexanamide Openeye Name: 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[2-chloro-5-hydroxy-4-(2,2,3,3,4,4,5,5-octafluoropentanoylamino)phenyl]hexanamide CAS Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-chloro-5-hydroxy-4-[(2,2,3,3,4,4,5,5-octafluoro-1-oxopentyl)amino]phenyl]hexanamide IUPAC Name: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-chloro-5-hydroxy-4-(2,2,3,3,4,4,5,5-octafluoropentanoylamino)phenyl]hexanamide Traditional Name: N-[2-chloro-5-hydroxy-4-(2,2,3,3,4,4,5,5-octafluoropentanoylamino)phenyl]-2-(2,4-ditert-amylphenoxy)hexanamide Formula: C33H41ClF8N2O4 MolecularWeight: 717.129866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F)O)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

Isomeric SMILES

CCCCC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F)O)OC2=C(C=C(C=C2)C(C)(C)CC)C(C)(C)CC

InChI

InChI=1S/C33H41ClF8N2O4/c1-8-11-12-25(48-24-14-13-18(29(4,5)9-2)15-19(24)30(6,7)10-3)26(46)43-21-17-23(45)22(16-20(21)34)44-28(47)32(39,40)33(41,42)31(37,38)27(35)36/h13-17,25,27,45H,8-12H2,1-7H3,(H,43,46)(H,44,47)