2-(4-bromanyl-2-fluoranyl-phenyl)-2-piperazin-1-yl-ethanenitrile

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-2-piperazin-1-yl-ethanenitrile Openeye Name: 2-(4-bromo-2-fluoro-phenyl)-2-piperazin-1-yl-acetonitrile CAS Name: 2-(4-bromo-2-fluorophenyl)-2-(1-piperazinyl)acetonitrile IUPAC Name: 2-(4-bromo-2-fluorophenyl)-2-piperazin-1-ylacetonitrile Traditional Name: 2-(4-bromo-2-fluoro-phenyl)-2-piperazino-acetonitrile Formula: C12H13BrFN3 MolecularWeight: 298.154123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrFN3/c13-9-1-2-10(11(14)7-9)12(8-15)17-5-3-16-4-6-17/h1-2,7,12,16H,3-6H2