N-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]-2-isoquinolin-5-yloxy-ethanamine trihydrochloride

Systemtic Name: N-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]-2-isoquinolin-5-yloxy-ethanamine trihydrochloride Openeye Name: N-[[5-(4-fluorophenyl)-3-pyridyl]methyl]-2-(5-isoquinolyloxy)ethanamine trihydrochloride CAS Name: N-[[5-(4-fluorophenyl)-3-pyridinyl]methyl]-2-(5-isoquinolinyloxy)ethanamine trihydrochloride IUPAC Name: N-[[5-(4-fluorophenyl)pyridin-3-yl]methyl]-2-isoquinolin-5-yloxyethanamine trihydrochloride Traditional Name: [5-(4-fluorophenyl)-3-pyridyl]methyl-[2-(5-isoquinolyloxy)ethyl]amine trihydrochloride Formula: C23H23Cl3FN3O MolecularWeight: 482.805623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)OCCNCC3=CN=CC(=C3)C4=CC=C(C=C4)F.Cl.Cl.Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)OCCNCC3=CN=CC(=C3)C4=CC=C(C=C4)F.Cl.Cl.Cl

InChI

InChI=1S/C23H20FN3O.3ClH/c24-21-6-4-18(5-7-21)20-12-17(14-27-16-20)13-26-10-11-28-23-3-1-2-19-15-25-9-8-22(19)23;;;/h1-9,12,14-16,26H,10-11,13H2;3*1H