4-[[3,4-bis(fluoranyl)phenyl]methyl]-2H-isoquinolin-1-one

Systemtic Name: 4-[[3,4-bis(fluoranyl)phenyl]methyl]-2H-isoquinolin-1-one Openeye Name: 4-[(3,4-difluorophenyl)methyl]-2H-isoquinolin-1-one CAS Name: 4-[(3,4-difluorophenyl)methyl]-2H-isoquinolin-1-one IUPAC Name: 4-[(3,4-difluorophenyl)methyl]-2H-isoquinolin-1-one Traditional Name: 4-(3,4-difluorobenzyl)isocarbostyril Formula: C16H11F2NO MolecularWeight: 271.261446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC2=O)CC3=CC(=C(C=C3)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNC2=O)CC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C16H11F2NO/c17-14-6-5-10(8-15(14)18)7-11-9-19-16(20)13-4-2-1-3-12(11)13/h1-6,8-9H,7H2,(H,19,20)