1-fluoranyl-3-octoxy-4-(5-octoxypyridin-2-yl)-5,6,7,8-tetrahydroisoquinoline

Systemtic Name: 1-fluoranyl-3-octoxy-4-(5-octoxypyridin-2-yl)-5,6,7,8-tetrahydroisoquinoline Openeye Name: 1-fluoro-3-octoxy-4-(5-octoxy-2-pyridyl)-5,6,7,8-tetrahydroisoquinoline CAS Name: 1-fluoro-3-octoxy-4-(5-octoxy-2-pyridinyl)-5,6,7,8-tetrahydroisoquinoline IUPAC Name: 1-fluoro-3-octoxy-4-(5-octoxypyridin-2-yl)-5,6,7,8-tetrahydroisoquinoline Traditional Name: 1-fluoro-3-octoxy-4-(5-octoxy-2-pyridyl)-5,6,7,8-tetrahydroisoquinoline Formula: C30H45FN2O2 MolecularWeight: 484.688903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(C=C1)C2=C3CCCCC3=C(N=C2OCCCCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=CN=C(C=C1)C2=C3CCCCC3=C(N=C2OCCCCCCCC)F

InChI

InChI=1S/C30H45FN2O2/c1-3-5-7-9-11-15-21-34-24-19-20-27(32-23-24)28-25-17-13-14-18-26(25)29(31)33-30(28)35-22-16-12-10-8-6-4-2/h19-20,23H,3-18,21-22H2,1-2H3