6-methoxy-3-[4-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one

Systemtic Name: 6-methoxy-3-[4-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one Openeye Name: 6-methoxy-3-[4-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one CAS Name: 6-methoxy-3-[4-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one IUPAC Name: 6-methoxy-3-[4-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one Traditional Name: 6-methoxy-3-[4-(trifluoromethyl)phenyl]isocarbostyril Formula: C17H12F3NO2 MolecularWeight: 319.27789

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)NC(=C2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)NC(=C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H12F3NO2/c1-23-13-6-7-14-11(8-13)9-15(21-16(14)22)10-2-4-12(5-3-10)17(18,19)20/h2-9H,1H3,(H,21,22)