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

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-N-butyl-N-ethyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-butyl-2-(2,4-difluorophenyl)-N-ethyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-butyl-2-(2,4-difluorophenyl)-N-ethyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-butyl-2-(2,4-difluorophenyl)-N-ethyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-butyl-2-(2,4-difluorophenyl)-N-ethyl-1-keto-isoquinoline-4-carboxamide Formula: C22H22F2N2O2 MolecularWeight: 384.419086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=C(C=C(C=C3)F)F

Isomeric SMILES

CCCCN(CC)C(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C22H22F2N2O2/c1-3-5-12-25(4-2)21(27)18-14-26(20-11-10-15(23)13-19(20)24)22(28)17-9-7-6-8-16(17)18/h6-11,13-14H,3-5,12H2,1-2H3