2-[4-(cyanomethyl)piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-(cyanomethyl)piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-(cyanomethyl)piperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-(cyanomethyl)-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-(cyanomethyl)piperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-(cyanomethyl)piperazino]-6-fluoro-benzonitrile Formula: C13H13FN4 MolecularWeight: 244.267523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C2=C(C(=CC=C2)F)C#N

Isomeric SMILES

C1CN(CCN1CC#N)C2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C13H13FN4/c14-12-2-1-3-13(11(12)10-16)18-8-6-17(5-4-15)7-9-18/h1-3H,5-9H2