1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromen-1-yl]propyl]-4-pyridin-2-yl-piperazine

Systemtic Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromen-1-yl]propyl]-4-pyridin-2-yl-piperazine Openeye Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-isochroman-1-yl]propyl]-4-(2-pyridyl)piperazine CAS Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl]propyl]-4-(2-pyridinyl)piperazine IUPAC Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromen-1-yl]propyl]-4-pyridin-2-ylpiperazine Traditional Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-isochroman-1-yl]propyl]-4-(2-pyridyl)piperazine Formula: C29H34FN3O3 MolecularWeight: 491.596963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCOC2(CCCN3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)F)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCOC2(CCCN3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)F)OC

InChI

InChI=1S/C29H34FN3O3/c1-34-26-20-22-11-19-36-29(25(22)21-27(26)35-2,23-7-9-24(30)10-8-23)12-5-14-32-15-17-33(18-16-32)28-6-3-4-13-31-28/h3-4,6-10,13,20-21H,5,11-12,14-19H2,1-2H3