(2-fluorophenyl)-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-fluorophenyl)-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (2-fluorophenyl)-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (2-fluorophenyl)-[4-(2-pyridinylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (2-fluorophenyl)-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (2-fluorophenyl)-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C17H19FN3O+ MolecularWeight: 300.350663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C17H18FN3O/c18-16-7-2-1-6-15(16)17(22)21-11-9-20(10-12-21)13-14-5-3-4-8-19-14/h1-8H,9-13H2/p+1