2-[[4-[[4-(4-chloranylphenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[[4-(4-chloranylphenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[[4-(4-chlorophenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[4-[[4-(4-chlorophenoxy)phenyl]methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[4-[[4-(4-chlorophenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-[4-(4-chlorophenoxy)benzyl]piperazino]methyl]benzonitrile Formula: C25H24ClN3O MolecularWeight: 417.93056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)CC4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)CC4=CC=CC=C4C#N

InChI

InChI=1S/C25H24ClN3O/c26-23-7-11-25(12-8-23)30-24-9-5-20(6-10-24)18-28-13-15-29(16-14-28)19-22-4-2-1-3-21(22)17-27/h1-12H,13-16,18-19H2