4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one CAS Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-fluorophenyl)butan-1-one Formula: C21H24FNO3 MolecularWeight: 357.418563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCC(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCC(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H24FNO3/c1-25-20-12-16-9-11-23(14-17(16)13-21(20)26-2)10-3-4-19(24)15-5-7-18(22)8-6-15/h5-8,12-13H,3-4,9-11,14H2,1-2H3