1-hexyl-2-[2-(trifluoromethyloxy)phenyl]-1H-isoquinoline

Systemtic Name: 1-hexyl-2-[2-(trifluoromethyloxy)phenyl]-1H-isoquinoline Openeye Name: 1-hexyl-2-[2-(trifluoromethoxy)phenyl]-1H-isoquinoline CAS Name: 1-hexyl-2-[2-(trifluoromethoxy)phenyl]-1H-isoquinoline IUPAC Name: 1-hexyl-2-[2-(trifluoromethoxy)phenyl]-1H-isoquinoline Traditional Name: 1-hexyl-2-[2-(trifluoromethoxy)phenyl]-1H-isoquinoline Formula: C22H24F3NO MolecularWeight: 375.42727

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C2=CC=CC=C2C=CN1C3=CC=CC=C3OC(F)(F)F

Isomeric SMILES

CCCCCCC1C2=CC=CC=C2C=CN1C3=CC=CC=C3OC(F)(F)F

InChI

InChI=1S/C22H24F3NO/c1-2-3-4-5-12-19-18-11-7-6-10-17(18)15-16-26(19)20-13-8-9-14-21(20)27-22(23,24)25/h6-11,13-16,19H,2-5,12H2,1H3