2-[2,4-bis(fluoranyl)phenyl]-N-(4-fluorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-N-(4-fluorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(2,4-difluorophenyl)-N-(4-fluorophenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(2,4-difluorophenyl)-N-(4-fluorophenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(2,4-difluorophenyl)-N-(4-fluorophenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(2,4-difluorophenyl)-N-(4-fluorophenyl)-1-keto-isoquinoline-4-carboxamide Formula: C22H13F3N2O2 MolecularWeight: 394.34603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN(C2=O)C3=C(C=C(C=C3)F)F)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN(C2=O)C3=C(C=C(C=C3)F)F)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H13F3N2O2/c23-13-5-8-15(9-6-13)26-21(28)18-12-27(20-10-7-14(24)11-19(20)25)22(29)17-4-2-1-3-16(17)18/h1-12H,(H,26,28)