3-[1-phenyl-3-(4-phenylpiperazin-1-yl)propoxy]benzenecarbonitrile

Systemtic Name: 3-[1-phenyl-3-(4-phenylpiperazin-1-yl)propoxy]benzenecarbonitrile Openeye Name: 3-[1-phenyl-3-(4-phenylpiperazin-1-yl)propoxy]benzonitrile CAS Name: 3-[1-phenyl-3-(4-phenyl-1-piperazinyl)propoxy]benzonitrile IUPAC Name: 3-[1-phenyl-3-(4-phenylpiperazin-1-yl)propoxy]benzonitrile Traditional Name: 3-[1-phenyl-3-(4-phenylpiperazino)propoxy]benzonitrile Formula: C26H27N3O MolecularWeight: 397.51208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC=CC(=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC=CC(=C3)C#N)C4=CC=CC=C4

InChI

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