4-(5-methoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide

Systemtic Name: 4-(5-methoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Openeye Name: 4-(5-methoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide CAS Name: 4-(5-methoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide IUPAC Name: 4-(5-methoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Traditional Name: 4-keto-4-(5-methoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-N-[3-(trifluoromethyl)benzyl]butyramide Formula: C28H27F3N2O3 MolecularWeight: 496.52079

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CCN(C2C3=CC=CC=C3)C(=O)CCC(=O)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

COC1=CC=CC2=C1CCN(C2C3=CC=CC=C3)C(=O)CCC(=O)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C28H27F3N2O3/c1-36-24-12-6-11-23-22(24)15-16-33(27(23)20-8-3-2-4-9-20)26(35)14-13-25(34)32-18-19-7-5-10-21(17-19)28(29,30)31/h2-12,17,27H,13-16,18H2,1H3,(H,32,34)