6-(4H-1,3-benzodioxin-2-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]hexanamide

Systemtic Name: 6-(4H-1,3-benzodioxin-2-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]hexanamide Openeye Name: 6-(4H-1,3-benzodioxin-2-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]hexanamide CAS Name: 6-(4H-1,3-benzodioxin-2-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]hexanamide IUPAC Name: 6-(4H-1,3-benzodioxin-2-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]hexanamide Traditional Name: 6-(4H-1,3-benzodioxin-2-ylmethylamino)-N-[3-(trifluoromethyl)phenyl]hexanamide Formula: C22H25F3N2O3 MolecularWeight: 422.44071

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC(O1)CNCCCCCC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1C2=CC=CC=C2OC(O1)CNCCCCCC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H25F3N2O3/c23-22(24,25)17-8-6-9-18(13-17)27-20(28)11-2-1-5-12-26-14-21-29-15-16-7-3-4-10-19(16)30-21/h3-4,6-10,13,21,26H,1-2,5,11-12,14-15H2,(H,27,28)