2-[3-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]propyl]-2-phenyl-hexanenitrile

Systemtic Name: 2-[3-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]propyl]-2-phenyl-hexanenitrile Openeye Name: 2-[3-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]propyl]-2-phenyl-hexanenitrile CAS Name: 2-[3-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]propyl]-2-phenylhexanenitrile IUPAC Name: 2-[3-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]propyl]-2-phenylhexanenitrile Traditional Name: 2-[3-[4-[2-(4-fluorophenoxy)ethyl]piperazino]propyl]-2-phenyl-hexanenitrile Formula: C27H36FN3O MolecularWeight: 437.592643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C27H36FN3O/c1-2-3-14-27(23-29,24-8-5-4-6-9-24)15-7-16-30-17-19-31(20-18-30)21-22-32-26-12-10-25(28)11-13-26/h4-6,8-13H,2-3,7,14-22H2,1H3