N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(2-bromo-4,6-difluoro-phenyl)-2-(3,4-dimethylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-2-(3,4-dimethylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-2-(3,4-dimethylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(2-bromo-4,6-difluoro-phenyl)-2-(3,4-dimethylphenyl)-1-keto-isoquinoline-4-carboxamide Formula: C24H17BrF2N2O2 MolecularWeight: 483.304786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=C(C=C(C=C4Br)F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=C(C=C(C=C4Br)F)F)C

InChI

InChI=1S/C24H17BrF2N2O2/c1-13-7-8-16(9-14(13)2)29-12-19(17-5-3-4-6-18(17)24(29)31)23(30)28-22-20(25)10-15(26)11-21(22)27/h3-12H,1-2H3,(H,28,30)