3-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one

Systemtic Name: 3-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one Openeye Name: 3-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one CAS Name: 3-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-1-(2-fluorophenyl)-6-methyl-4-pyridazinone IUPAC Name: 3-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-(2-fluorophenyl)-6-methylpyridazin-4-one Traditional Name: 3-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-(2-fluorophenyl)-6-methyl-pyridazin-4-one Formula: C25H26FN3O4 MolecularWeight: 451.490043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4F)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4F)OCC

InChI

InChI=1S/C25H26FN3O4/c1-4-32-22-13-17-10-11-28(15-18(17)14-23(22)33-5-2)25(31)24-21(30)12-16(3)29(27-24)20-9-7-6-8-19(20)26/h6-9,12-14H,4-5,10-11,15H2,1-3H3