3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-phenyl-propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-phenyl-propoxy]benzenecarbonitrile Openeye Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-phenyl-propoxy]benzonitrile CAS Name: 3-[3-[4-(4-fluorophenyl)-1-piperazinyl]-1-phenylpropoxy]benzonitrile IUPAC Name: 3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-1-phenylpropoxy]benzonitrile Traditional Name: 3-[3-[4-(4-fluorophenyl)piperazino]-1-phenyl-propoxy]benzonitrile Formula: C26H26FN3O MolecularWeight: 415.502543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC=CC(=C3)C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC=CC(=C3)C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H26FN3O/c27-23-9-11-24(12-10-23)30-17-15-29(16-18-30)14-13-26(22-6-2-1-3-7-22)31-25-8-4-5-21(19-25)20-28/h1-12,19,26H,13-18H2