5-[4-[2-(2-ethoxy-4-fluoranyl-phenoxy)ethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-[2-(2-ethoxy-4-fluoranyl-phenoxy)ethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-[2-(2-ethoxy-4-fluoro-phenoxy)ethyl]piperazin-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-[2-(2-ethoxy-4-fluorophenoxy)ethyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-[2-(2-ethoxy-4-fluorophenoxy)ethyl]piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-[2-(2-ethoxy-4-fluoro-phenoxy)ethyl]piperazino]-2-isopropyl-2-phenyl-valeronitrile Formula: C28H38FN3O2 MolecularWeight: 467.618623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)F)OCCN2CCN(CC2)CCCC(C#N)(C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)F)OCCN2CCN(CC2)CCCC(C#N)(C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C28H38FN3O2/c1-4-33-27-21-25(29)11-12-26(27)34-20-19-32-17-15-31(16-18-32)14-8-13-28(22-30,23(2)3)24-9-6-5-7-10-24/h5-7,9-12,21,23H,4,8,13-20H2,1-3H3