3-fluoranyl-4-piperazin-4-ium-1-yl-benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-piperazin-4-ium-1-yl-benzenecarbonitrile Openeye Name: 3-fluoro-4-piperazin-4-ium-1-yl-benzonitrile CAS Name: 3-fluoro-4-(1-piperazin-4-iumyl)benzonitrile IUPAC Name: 3-fluoro-4-piperazin-4-ium-1-ylbenzonitrile Traditional Name: 3-fluoro-4-piperazin-4-ium-1-yl-benzonitrile Formula: C11H13FN3+ MolecularWeight: 206.239423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1CN(CC[NH2+]1)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C11H12FN3/c12-10-7-9(8-13)1-2-11(10)15-5-3-14-4-6-15/h1-2,7,14H,3-6H2/p+1