5-[4-[2-(3-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-[2-(3-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-[2-(3-fluorophenoxy)ethyl]piperazin-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-[2-(3-fluorophenoxy)ethyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-[2-(3-fluorophenoxy)ethyl]piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-[2-(3-fluorophenoxy)ethyl]piperazino]-2-isopropyl-2-phenyl-valeronitrile Formula: C26H34FN3O MolecularWeight: 423.566063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34FN3O/c1-22(2)26(21-28,23-8-4-3-5-9-23)12-7-13-29-14-16-30(17-15-29)18-19-31-25-11-6-10-24(27)20-25/h3-6,8-11,20,22H,7,12-19H2,1-2H3