2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-[bis(4-fluorophenyl)methyl]piperazino]methyl]benzonitrile Formula: C25H23F2N3 MolecularWeight: 403.467026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2C#N)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2C#N)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H23F2N3/c26-23-9-5-19(6-10-23)25(20-7-11-24(27)12-8-20)30-15-13-29(14-16-30)18-22-4-2-1-3-21(22)17-28/h1-12,25H,13-16,18H2