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

Systemtic Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromen-1-yl]propyl]-4-phenyl-piperazine Openeye Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-isochroman-1-yl]propyl]-4-phenyl-piperazine CAS Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl]propyl]-4-phenylpiperazine IUPAC Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisochromen-1-yl]propyl]-4-phenylpiperazine Traditional Name: 1-[3-[1-(4-fluorophenyl)-6,7-dimethoxy-isochroman-1-yl]propyl]-4-phenyl-piperazine Formula: C30H35FN2O3 MolecularWeight: 490.608903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H35FN2O3/c1-34-28-21-23-13-20-36-30(27(23)22-29(28)35-2,24-9-11-25(31)12-10-24)14-6-15-32-16-18-33(19-17-32)26-7-4-3-5-8-26/h3-5,7-12,21-22H,6,13-20H2,1-2H3