2-[2,4-bis(fluoranyl)phenyl]-N-(2-methoxy-5-methyl-phenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-N-(2-methoxy-5-methyl-phenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(2,4-difluorophenyl)-N-(2-methoxy-5-methyl-phenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(2,4-difluorophenyl)-N-(2-methoxy-5-methylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(2,4-difluorophenyl)-N-(2-methoxy-5-methylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(2,4-difluorophenyl)-1-keto-N-(2-methoxy-5-methyl-phenyl)isoquinoline-4-carboxamide Formula: C24H18F2N2O3 MolecularWeight: 420.408126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C24H18F2N2O3/c1-14-7-10-22(31-2)20(11-14)27-23(29)18-13-28(21-9-8-15(25)12-19(21)26)24(30)17-6-4-3-5-16(17)18/h3-13H,1-2H3,(H,27,29)