1-(azocan-1-yl)-3-[5-[[(3-fluorophenyl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol

Systemtic Name: 1-(azocan-1-yl)-3-[5-[[(3-fluorophenyl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol Openeye Name: 1-(azocan-1-yl)-3-[5-[[(3-fluorophenyl)methylamino]methyl]-2-methoxy-phenoxy]propan-2-ol CAS Name: 1-(1-azocanyl)-3-[5-[[(3-fluorophenyl)methylamino]methyl]-2-methoxyphenoxy]-2-propanol IUPAC Name: 1-(azocan-1-yl)-3-[5-[[(3-fluorophenyl)methylamino]methyl]-2-methoxyphenoxy]propan-2-ol Traditional Name: 1-(azocan-1-yl)-3-[5-[[(3-fluorobenzyl)amino]methyl]-2-methoxy-phenoxy]propan-2-ol Formula: C25H35FN2O3 MolecularWeight: 430.555403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCC2=CC(=CC=C2)F)OCC(CN3CCCCCCC3)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNCC2=CC(=CC=C2)F)OCC(CN3CCCCCCC3)O

InChI

InChI=1S/C25H35FN2O3/c1-30-24-11-10-21(17-27-16-20-8-7-9-22(26)14-20)15-25(24)31-19-23(29)18-28-12-5-3-2-4-6-13-28/h7-11,14-15,23,27,29H,2-6,12-13,16-19H2,1H3