6-piperidin-1-yl-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one

Systemtic Name: 6-piperidin-1-yl-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one Openeye Name: 6-(1-piperidyl)-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one CAS Name: 6-(1-piperidinyl)-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one IUPAC Name: 6-piperidin-1-yl-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one Traditional Name: 6-piperidino-3-[2-(trifluoromethyl)phenyl]isocarbostyril Formula: C21H19F3N2O MolecularWeight: 372.38357

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC3=C(C=C2)C(=O)NC(=C3)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C2=CC3=C(C=C2)C(=O)NC(=C3)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H19F3N2O/c22-21(23,24)18-7-3-2-6-17(18)19-13-14-12-15(26-10-4-1-5-11-26)8-9-16(14)20(27)25-19/h2-3,6-9,12-13H,1,4-5,10-11H2,(H,25,27)