3-[4-(4-fluorophenyl)piperazin-1-yl]-4-phenyl-1-propyl-3,4-dihydroisoquinoline dihydrochloride

Systemtic Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-4-phenyl-1-propyl-3,4-dihydroisoquinoline dihydrochloride Openeye Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-4-phenyl-1-propyl-3,4-dihydroisoquinoline dihydrochloride CAS Name: 3-[4-(4-fluorophenyl)-1-piperazinyl]-4-phenyl-1-propyl-3,4-dihydroisoquinoline dihydrochloride IUPAC Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-4-phenyl-1-propyl-3,4-dihydroisoquinoline dihydrochloride Traditional Name: 3-[4-(4-fluorophenyl)piperazino]-4-phenyl-1-propyl-3,4-dihydroisoquinoline dihydrochloride Formula: C28H32Cl2FN3 MolecularWeight: 500.478183

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(C(C2=CC=CC=C21)C3=CC=CC=C3)N4CCN(CC4)C5=CC=C(C=C5)F.Cl.Cl

Isomeric SMILES

CCCC1=NC(C(C2=CC=CC=C21)C3=CC=CC=C3)N4CCN(CC4)C5=CC=C(C=C5)F.Cl.Cl

InChI

InChI=1S/C28H30FN3.2ClH/c1-2-8-26-24-11-6-7-12-25(24)27(21-9-4-3-5-10-21)28(30-26)32-19-17-31(18-20-32)23-15-13-22(29)14-16-23;;/h3-7,9-16,27-28H,2,8,17-20H2,1H3;2*1H