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

Systemtic Name: 2-(4-dimethylaminophenyl)-5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(4-dimethylaminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-isopropyl-pentanenitrile CAS Name: 2-(4-dimethylaminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(4-dimethylaminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-propan-2-ylpentanenitrile Traditional Name: 2-(4-dimethylaminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-2-isopropyl-valeronitrile Formula: C28H39FN4O MolecularWeight: 466.633863

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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=C(C=C3)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H39FN4O/c1-23(2)28(22-30,24-6-10-26(11-7-24)31(3)4)14-5-15-32-16-18-33(19-17-32)20-21-34-27-12-8-25(29)9-13-27/h6-13,23H,5,14-21H2,1-4H3