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

Systemtic Name: 2-(2-chlorophenyl)-5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(2-chlorophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-isopropyl-pentanenitrile CAS Name: 2-(2-chlorophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(2-chlorophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-propan-2-ylpentanenitrile Traditional Name: 2-(2-chlorophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-2-isopropyl-valeronitrile Formula: C26H33ClFN3O MolecularWeight: 458.011123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3Cl

InChI

InChI=1S/C26H33ClFN3O/c1-21(2)26(20-29,24-6-3-4-7-25(24)27)12-5-13-30-14-16-31(17-15-30)18-19-32-23-10-8-22(28)9-11-23/h3-4,6-11,21H,5,12-19H2,1-2H3