1-[6-(fluoranylmethyl)-1-oxidanidyl-pyridin-1-ium-2-yl]-4-phenyl-piperazine

Systemtic Name: 1-[6-(fluoranylmethyl)-1-oxidanidyl-pyridin-1-ium-2-yl]-4-phenyl-piperazine Openeye Name: 1-[6-(fluoromethyl)-1-oxido-pyridin-1-ium-2-yl]-4-phenyl-piperazine CAS Name: 1-[6-(fluoromethyl)-1-oxido-2-pyridin-1-iumyl]-4-phenylpiperazine IUPAC Name: 1-[6-(fluoromethyl)-1-oxidopyridin-1-ium-2-yl]-4-phenylpiperazine Traditional Name: 1-[6-(fluoromethyl)-1-oxido-pyridin-1-ium-2-yl]-4-phenyl-piperazine Formula: C16H18FN3O MolecularWeight: 287.332023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=CC=CC(=[N+]3[O-])CF

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=CC=CC(=[N+]3[O-])CF

InChI

InChI=1S/C16H18FN3O/c17-13-15-7-4-8-16(20(15)21)19-11-9-18(10-12-19)14-5-2-1-3-6-14/h1-8H,9-13H2