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

Systemtic Name: 5-[4-[2-(4-fluoranylphenoxy)butyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-[2-(4-fluorophenoxy)butyl]piperazin-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-[2-(4-fluorophenoxy)butyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-[2-(4-fluorophenoxy)butyl]piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-[2-(4-fluorophenoxy)butyl]piperazino]-2-isopropyl-2-phenyl-valeronitrile Formula: C28H38FN3O MolecularWeight: 451.619223

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CCN(CC1)CCCC(C#N)(C2=CC=CC=C2)C(C)C)OC3=CC=C(C=C3)F

Isomeric SMILES

CCC(CN1CCN(CC1)CCCC(C#N)(C2=CC=CC=C2)C(C)C)OC3=CC=C(C=C3)F

InChI

InChI=1S/C28H38FN3O/c1-4-26(33-27-13-11-25(29)12-14-27)21-32-19-17-31(18-20-32)16-8-15-28(22-30,23(2)3)24-9-6-5-7-10-24/h5-7,9-14,23,26H,4,8,15-21H2,1-3H3