5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N,2-dimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide

Systemtic Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N,2-dimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide Openeye Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N,2-dimethyl-1-oxo-4-phenyl-isoquinoline-3-carboxamide CAS Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N,2-dimethyl-1-oxo-4-phenyl-3-isoquinolinecarboxamide IUPAC Name: 5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N,2-dimethyl-1-oxo-4-phenylisoquinoline-3-carboxamide Traditional Name: 5-[3,5-bis(trifluoromethyl)benzyl]-1-keto-N,2-dimethyl-4-phenyl-isoquinoline-3-carboxamide Formula: C27H20F6N2O2 MolecularWeight: 518.450319

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=C(C2=C(C=CC=C2CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)N1C)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1=C(C2=C(C=CC=C2CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)N1C)C4=CC=CC=C4

InChI

InChI=1S/C27H20F6N2O2/c1-34-24(36)23-22(16-7-4-3-5-8-16)21-17(9-6-10-20(21)25(37)35(23)2)11-15-12-18(26(28,29)30)14-19(13-15)27(31,32)33/h3-10,12-14H,11H2,1-2H3,(H,34,36)