2-[2,4-bis(fluoranyl)phenyl]-N-(3-chlorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-N-(3-chlorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(3-chlorophenyl)-2-(2,4-difluorophenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(3-chlorophenyl)-2-(2,4-difluorophenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(3-chlorophenyl)-2-(2,4-difluorophenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(3-chlorophenyl)-2-(2,4-difluorophenyl)-1-keto-isoquinoline-4-carboxamide Formula: C22H13ClF2N2O2 MolecularWeight: 410.800626

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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(=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H13ClF2N2O2/c23-13-4-3-5-15(10-13)26-21(28)18-12-27(20-9-8-14(24)11-19(20)25)22(29)17-7-2-1-6-16(17)18/h1-12H,(H,26,28)