1-[[(2R,3R)-3-(4-fluoranylphenoxy)-1-(4-methoxyphenyl)azetidin-2-yl]methyl]-4-(phenylmethyl)piperazine

Systemtic Name: 1-[[(2R,3R)-3-(4-fluoranylphenoxy)-1-(4-methoxyphenyl)azetidin-2-yl]methyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[[(2R,3R)-3-(4-fluorophenoxy)-1-(4-methoxyphenyl)azetidin-2-yl]methyl]piperazine CAS Name: 1-[[(2R,3R)-3-(4-fluorophenoxy)-1-(4-methoxyphenyl)-2-azetidinyl]methyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[[(2R,3R)-3-(4-fluorophenoxy)-1-(4-methoxyphenyl)azetidin-2-yl]methyl]piperazine Traditional Name: 1-benzyl-4-[[(2R,3R)-3-(4-fluorophenoxy)-1-(4-methoxyphenyl)azetidin-2-yl]methyl]piperazine Formula: C28H32FN3O2 MolecularWeight: 461.570983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(C2CN3CCN(CC3)CC4=CC=CC=C4)OC5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)N2C[C@H]([C@H]2CN3CCN(CC3)CC4=CC=CC=C4)OC5=CC=C(C=C5)F

InChI

InChI=1S/C28H32FN3O2/c1-33-25-13-9-24(10-14-25)32-21-28(34-26-11-7-23(29)8-12-26)27(32)20-31-17-15-30(16-18-31)19-22-5-3-2-4-6-22/h2-14,27-28H,15-21H2,1H3/t27-,28-/m1/s1