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

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(2-bromo-4,6-difluoro-phenyl)-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(2-bromo-4,6-difluoro-phenyl)-1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C23H15BrF2N2O3 MolecularWeight: 485.277606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=C(C=C(C=C4Br)F)F

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=C(C=C(C=C4Br)F)F

InChI

InChI=1S/C23H15BrF2N2O3/c1-31-15-8-6-14(7-9-15)28-12-18(16-4-2-3-5-17(16)23(28)30)22(29)27-21-19(24)10-13(25)11-20(21)26/h2-12H,1H3,(H,27,29)