N-(2-cyano-3-fluoranyl-phenyl)-3,5,5-trimethyl-hexanamide

Systemtic Name: N-(2-cyano-3-fluoranyl-phenyl)-3,5,5-trimethyl-hexanamide Openeye Name: N-(2-cyano-3-fluoro-phenyl)-3,5,5-trimethyl-hexanamide CAS Name: N-(2-cyano-3-fluorophenyl)-3,5,5-trimethylhexanamide IUPAC Name: N-(2-cyano-3-fluorophenyl)-3,5,5-trimethylhexanamide Traditional Name: N-(2-cyano-3-fluoro-phenyl)-3,5,5-trimethyl-hexanamide Formula: C16H21FN2O MolecularWeight: 276.349143

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(C(=CC=C1)F)C#N)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)NC1=C(C(=CC=C1)F)C#N)CC(C)(C)C

InChI

InChI=1S/C16H21FN2O/c1-11(9-16(2,3)4)8-15(20)19-14-7-5-6-13(17)12(14)10-18/h5-7,11H,8-9H2,1-4H3,(H,19,20)