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

Systemtic Name: 2-(4-aminophenyl)-5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(4-aminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-isopropyl-pentanenitrile CAS Name: 2-(4-aminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(4-aminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-propan-2-ylpentanenitrile Traditional Name: 2-(4-aminophenyl)-5-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-2-isopropyl-valeronitrile Formula: C26H35FN4O MolecularWeight: 438.580703

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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

Isomeric SMILES

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

InChI

InChI=1S/C26H35FN4O/c1-21(2)26(20-28,22-4-8-24(29)9-5-22)12-3-13-30-14-16-31(17-15-30)18-19-32-25-10-6-23(27)7-11-25/h4-11,21H,3,12-19,29H2,1-2H3