2-[2,5-bis(fluoranyl)phenyl]-2-piperazin-1-yl-ethanenitrile

Systemtic Name: 2-[2,5-bis(fluoranyl)phenyl]-2-piperazin-1-yl-ethanenitrile Openeye Name: 2-(2,5-difluorophenyl)-2-piperazin-1-yl-acetonitrile CAS Name: 2-(2,5-difluorophenyl)-2-(1-piperazinyl)acetonitrile IUPAC Name: 2-(2,5-difluorophenyl)-2-piperazin-1-ylacetonitrile Traditional Name: 2-(2,5-difluorophenyl)-2-piperazino-acetonitrile Formula: C12H13F2N3 MolecularWeight: 237.248526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(C#N)C2=C(C=CC(=C2)F)F

Isomeric SMILES

C1CN(CCN1)C(C#N)C2=C(C=CC(=C2)F)F

InChI

InChI=1S/C12H13F2N3/c13-9-1-2-11(14)10(7-9)12(8-15)17-5-3-16-4-6-17/h1-2,7,12,16H,3-6H2