1-(3-fluoranyl-4-phenylmethoxy-phenyl)-4-octyl-piperazine

Systemtic Name: 1-(3-fluoranyl-4-phenylmethoxy-phenyl)-4-octyl-piperazine Openeye Name: 1-(4-benzyloxy-3-fluoro-phenyl)-4-octyl-piperazine CAS Name: 1-(3-fluoro-4-phenylmethoxyphenyl)-4-octylpiperazine IUPAC Name: 1-(3-fluoro-4-phenylmethoxyphenyl)-4-octylpiperazine Traditional Name: 1-(4-benzoxy-3-fluoro-phenyl)-4-octyl-piperazine Formula: C25H35FN2O MolecularWeight: 398.556603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCN(CC1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)F

Isomeric SMILES

CCCCCCCCN1CCN(CC1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)F

InChI

InChI=1S/C25H35FN2O/c1-2-3-4-5-6-10-15-27-16-18-28(19-17-27)23-13-14-25(24(26)20-23)29-21-22-11-8-7-9-12-22/h7-9,11-14,20H,2-6,10,15-19,21H2,1H3