1-[5-(fluoranylmethyl)-1-oxidanidyl-pyridin-1-ium-2-yl]-4-phenyl-piperazine

Systemtic Name: 1-[5-(fluoranylmethyl)-1-oxidanidyl-pyridin-1-ium-2-yl]-4-phenyl-piperazine Openeye Name: 1-[5-(fluoromethyl)-1-oxido-pyridin-1-ium-2-yl]-4-phenyl-piperazine CAS Name: 1-[5-(fluoromethyl)-1-oxido-2-pyridin-1-iumyl]-4-phenylpiperazine IUPAC Name: 1-[5-(fluoromethyl)-1-oxidopyridin-1-ium-2-yl]-4-phenylpiperazine Traditional Name: 1-[5-(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=[N+](C=C(C=C3)CF)[O-]

Isomeric SMILES

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

InChI

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