2-ethyl-5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-phenyl-pentanenitrile

Systemtic Name: 2-ethyl-5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-phenyl-pentanenitrile Openeye Name: 2-ethyl-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-phenyl-pentanenitrile CAS Name: 2-ethyl-5-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-phenylpentanenitrile IUPAC Name: 2-ethyl-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-phenylpentanenitrile Traditional Name: 2-ethyl-5-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-2-phenyl-valeronitrile Formula: C25H32FN3O MolecularWeight: 409.539483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32FN3O/c1-2-25(21-27,22-7-4-3-5-8-22)13-6-14-28-15-17-29(18-16-28)19-20-30-24-11-9-23(26)10-12-24/h3-5,7-12H,2,6,13-20H2,1H3