2-[[2,4-bis(fluoranyl)phenyl]methyl]-5,6-bis(chloranyl)-3-(4-phenoxyphenyl)isoquinolin-1-one

Systemtic Name: 2-[[2,4-bis(fluoranyl)phenyl]methyl]-5,6-bis(chloranyl)-3-(4-phenoxyphenyl)isoquinolin-1-one Openeye Name: 5,6-dichloro-2-[(2,4-difluorophenyl)methyl]-3-(4-phenoxyphenyl)isoquinolin-1-one CAS Name: 5,6-dichloro-2-[(2,4-difluorophenyl)methyl]-3-(4-phenoxyphenyl)-1-isoquinolinone IUPAC Name: 5,6-dichloro-2-[(2,4-difluorophenyl)methyl]-3-(4-phenoxyphenyl)isoquinolin-1-one Traditional Name: 5,6-dichloro-2-(2,4-difluorobenzyl)-3-(4-phenoxyphenyl)isocarbostyril Formula: C28H17Cl2F2NO2 MolecularWeight: 508.342886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC4=C(C=CC(=C4Cl)Cl)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=CC(=C4Cl)Cl)C(=O)N3CC5=C(C=C(C=C5)F)F

InChI

InChI=1S/C28H17Cl2F2NO2/c29-24-13-12-22-23(27(24)30)15-26(33(28(22)34)16-18-6-9-19(31)14-25(18)32)17-7-10-21(11-8-17)35-20-4-2-1-3-5-20/h1-15H,16H2