2-methyl-3-[4-(trifluoromethyl)phenyl]isoquinolin-1-one

Systemtic Name: 2-methyl-3-[4-(trifluoromethyl)phenyl]isoquinolin-1-one Openeye Name: 2-methyl-3-[4-(trifluoromethyl)phenyl]isoquinolin-1-one CAS Name: 2-methyl-3-[4-(trifluoromethyl)phenyl]-1-isoquinolinone IUPAC Name: 2-methyl-3-[4-(trifluoromethyl)phenyl]isoquinolin-1-one Traditional Name: 2-methyl-3-[4-(trifluoromethyl)phenyl]isocarbostyril Formula: C17H12F3NO MolecularWeight: 303.27849

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=CC=CC=C2C1=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN1C(=CC2=CC=CC=C2C1=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H12F3NO/c1-21-15(10-12-4-2-3-5-14(12)16(21)22)11-6-8-13(9-7-11)17(18,19)20/h2-10H,1H3