3-[[4-[[4-(4-chloranylphenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[[4-(4-chloranylphenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[[4-(4-chlorophenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[[4-(4-chlorophenoxy)phenyl]methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[[4-(4-chlorophenoxy)phenyl]methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[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(=C4)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)OC3=CC=C(C=C3)Cl)CC4=CC=CC(=C4)C#N

InChI

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