1-[4-(3-fluoranyl-4-phenylmethoxy-phenyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-(3-fluoranyl-4-phenylmethoxy-phenyl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-(4-benzyloxy-3-fluoro-phenyl)piperazin-1-yl]pentan-1-one CAS Name: 1-[4-(3-fluoro-4-phenylmethoxyphenyl)-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-(3-fluoro-4-phenylmethoxyphenyl)piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-(4-benzoxy-3-fluoro-phenyl)piperazino]pentan-1-one Formula: C22H27FN2O2 MolecularWeight: 370.460383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)F

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)F

InChI

InChI=1S/C22H27FN2O2/c1-2-3-9-22(26)25-14-12-24(13-15-25)19-10-11-21(20(23)16-19)27-17-18-7-5-4-6-8-18/h4-8,10-11,16H,2-3,9,12-15,17H2,1H3