4-[1-[4-[2-(3-cyanophenoxy)ethyl]piperazin-1-yl]hexyl]-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[1-[4-[2-(3-cyanophenoxy)ethyl]piperazin-1-yl]hexyl]-2-methyl-benzenecarbonitrile Openeye Name: 4-[1-[4-[2-(3-cyanophenoxy)ethyl]piperazin-1-yl]hexyl]-2-methyl-benzonitrile CAS Name: 4-[1-[4-[2-(3-cyanophenoxy)ethyl]-1-piperazinyl]hexyl]-2-methylbenzonitrile IUPAC Name: 4-[1-[4-[2-(3-cyanophenoxy)ethyl]piperazin-1-yl]hexyl]-2-methylbenzonitrile Traditional Name: 4-[1-[4-[2-(3-cyanophenoxy)ethyl]piperazino]hexyl]-2-methyl-benzonitrile Formula: C27H34N4O MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N4O/c1-3-4-5-9-27(24-10-11-25(21-29)22(2)18-24)31-14-12-30(13-15-31)16-17-32-26-8-6-7-23(19-26)20-28/h6-8,10-11,18-19,27H,3-5,9,12-17H2,1-2H3