2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[(2-fluorophenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[(2-fluorophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[(2-fluorophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[(2-fluorophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-[(2-fluorophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluorobenzyl)cinchoninamide Formula: C28H26FN3O3 MolecularWeight: 471.522743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC=CC=C5F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C3=NC4=CC=CC=C4C(=C3)C(=O)NCC5=CC=CC=C5F)OC

InChI

InChI=1S/C28H26FN3O3/c1-34-25-13-18-11-12-32(17-20(18)14-26(25)35-2)27-15-22(21-8-4-6-10-24(21)31-27)28(33)30-16-19-7-3-5-9-23(19)29/h3-10,13-15H,11-12,16-17H2,1-2H3,(H,30,33)