2-[[2,4-bis(fluoranyl)phenyl]methyl]-7-fluoranyl-3-(4-phenoxyphenyl)isoquinolin-1-one

Systemtic Name: 2-[[2,4-bis(fluoranyl)phenyl]methyl]-7-fluoranyl-3-(4-phenoxyphenyl)isoquinolin-1-one Openeye Name: 2-[(2,4-difluorophenyl)methyl]-7-fluoro-3-(4-phenoxyphenyl)isoquinolin-1-one CAS Name: 2-[(2,4-difluorophenyl)methyl]-7-fluoro-3-(4-phenoxyphenyl)-1-isoquinolinone IUPAC Name: 2-[(2,4-difluorophenyl)methyl]-7-fluoro-3-(4-phenoxyphenyl)isoquinolin-1-one Traditional Name: 2-(2,4-difluorobenzyl)-7-fluoro-3-(4-phenoxyphenyl)isocarbostyril Formula: C28H18F3NO2 MolecularWeight: 457.44323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC4=C(C=C(C=C4)F)C(=O)N3CC5=C(C=C(C=C5)F)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC4=C(C=C(C=C4)F)C(=O)N3CC5=C(C=C(C=C5)F)F

InChI

InChI=1S/C28H18F3NO2/c29-21-10-6-19-14-27(18-8-12-24(13-9-18)34-23-4-2-1-3-5-23)32(28(33)25(19)15-21)17-20-7-11-22(30)16-26(20)31/h1-16H,17H2