2-(2-cyanophenoxy)-N-[4-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-3-oxidanyl-phenyl]tetradecanamide

Systemtic Name: 2-(2-cyanophenoxy)-N-[4-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-3-oxidanyl-phenyl]tetradecanamide Openeye Name: 2-(2-cyanophenoxy)-N-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-3-hydroxy-phenyl]tetradecanamide CAS Name: 2-(2-cyanophenoxy)-N-[4-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-3-hydroxyphenyl]tetradecanamide IUPAC Name: 2-(2-cyanophenoxy)-N-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-3-hydroxyphenyl]tetradecanamide Traditional Name: 2-(2-cyanophenoxy)-N-[4-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-3-hydroxy-phenyl]myristamide Formula: C31H36F7N3O4 MolecularWeight: 647.624062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)NC1=CC(=C(C=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)O)OC2=CC=CC=C2C#N

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)NC1=CC(=C(C=C1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)O)OC2=CC=CC=C2C#N

InChI

InChI=1S/C31H36F7N3O4/c1-2-3-4-5-6-7-8-9-10-11-16-26(45-25-15-13-12-14-21(25)20-39)27(43)40-22-17-18-23(24(42)19-22)41-28(44)29(32,33)30(34,35)31(36,37)38/h12-15,17-19,26,42H,2-11,16H2,1H3,(H,40,43)(H,41,44)