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

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(2,4-difluorophenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,4-difluorophenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,4-difluorophenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(2,4-difluorophenyl)-1-keto-isoquinoline-4-carboxamide Formula: C24H17ClF2N2O3 MolecularWeight: 454.853186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)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=C1Cl)OC)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C24H17ClF2N2O3/c1-13-9-20(22(32-2)11-18(13)25)28-23(30)17-12-29(21-8-7-14(26)10-19(21)27)24(31)16-6-4-3-5-15(16)17/h3-12H,1-2H3,(H,28,30)