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

Systemtic Name: 4-[1-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]hexyl]-2-methyl-5-oxidanyl-benzenecarbonitrile Openeye Name: 4-[1-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]hexyl]-5-hydroxy-2-methyl-benzonitrile CAS Name: 4-[1-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]hexyl]-5-hydroxy-2-methylbenzonitrile IUPAC Name: 4-[1-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]hexyl]-5-hydroxy-2-methylbenzonitrile Traditional Name: 4-[1-[4-[2-(4-fluorophenoxy)ethyl]piperazino]hexyl]-5-hydroxy-2-methyl-benzonitrile Formula: C26H34FN3O2 MolecularWeight: 439.565463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34FN3O2/c1-3-4-5-6-25(24-17-20(2)21(19-28)18-26(24)31)30-13-11-29(12-14-30)15-16-32-23-9-7-22(27)8-10-23/h7-10,17-18,25,31H,3-6,11-16H2,1-2H3