5-[1-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]pentyl]-2-methyl-benzenecarbonitrile

Systemtic Name: 5-[1-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]pentyl]-2-methyl-benzenecarbonitrile Openeye Name: 5-[1-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]pentyl]-2-methyl-benzonitrile CAS Name: 5-[1-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]pentyl]-2-methylbenzonitrile IUPAC Name: 5-[1-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]pentyl]-2-methylbenzonitrile Traditional Name: 5-[1-[4-[2-(4-fluorophenoxy)ethyl]piperazino]pentyl]-2-methyl-benzonitrile Formula: C25H32FN3O MolecularWeight: 409.539483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1)C)C#N)N2CCN(CC2)CCOC3=CC=C(C=C3)F

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1)C)C#N)N2CCN(CC2)CCOC3=CC=C(C=C3)F

InChI

InChI=1S/C25H32FN3O/c1-3-4-5-25(21-7-6-20(2)22(18-21)19-27)29-14-12-28(13-15-29)16-17-30-24-10-8-23(26)9-11-24/h6-11,18,25H,3-5,12-17H2,1-2H3