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

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-N-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(2,4-difluorophenyl)-N-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(2,4-difluorophenyl)-N-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(2,4-difluorophenyl)-N-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(2,4-difluorophenyl)-1-keto-N-(3-methoxyphenyl)isoquinoline-4-carboxamide Formula: C23H16F2N2O3 MolecularWeight: 406.381546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C23H16F2N2O3/c1-30-16-6-4-5-15(12-16)26-22(28)19-13-27(21-10-9-14(24)11-20(21)25)23(29)18-8-3-2-7-17(18)19/h2-13H,1H3,(H,26,28)