2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(4-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-[4-(4-fluorophenyl)piperazino]ethanone Formula: C23H28FN3O3 MolecularWeight: 413.485123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C23H28FN3O3/c1-29-21-13-17-7-8-25(15-18(17)14-22(21)30-2)16-23(28)27-11-9-26(10-12-27)20-5-3-19(24)4-6-20/h3-6,13-14H,7-12,15-16H2,1-2H3