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

Systemtic Name: 5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-(2-oxidanylpropan-2-yl)-2-phenyl-pentanenitrile Openeye Name: 5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-(1-hydroxy-1-methyl-ethyl)-2-phenyl-pentanenitrile CAS Name: 5-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-(2-hydroxypropan-2-yl)-2-phenylpentanenitrile IUPAC Name: 5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-(2-hydroxypropan-2-yl)-2-phenylpentanenitrile Traditional Name: 5-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-2-(1-hydroxy-1-methyl-ethyl)-2-phenyl-valeronitrile Formula: C26H34FN3O2 MolecularWeight: 439.565463

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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=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C26H34FN3O2/c1-25(2,31)26(21-28,22-7-4-3-5-8-22)13-6-14-29-15-17-30(18-16-29)19-20-32-24-11-9-23(27)10-12-24/h3-5,7-12,31H,6,13-20H2,1-2H3