3-[[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[(2-benzyloxyphenyl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[(2-phenylmethoxyphenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[(2-phenylmethoxyphenyl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(2-benzoxybenzyl)piperazino]methyl]benzonitrile Formula: C26H27N3O MolecularWeight: 397.51208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C#N)CC3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C#N)CC3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O/c27-18-23-9-6-10-24(17-23)19-28-13-15-29(16-14-28)20-25-11-4-5-12-26(25)30-21-22-7-2-1-3-8-22/h1-12,17H,13-16,19-21H2