1-(5-fluoranylhexadecyl)pyrimidin-1-ium

Systemtic Name: 1-(5-fluoranylhexadecyl)pyrimidin-1-ium Openeye Name: 1-(5-fluorohexadecyl)pyrimidin-1-ium CAS Name: 1-(5-fluorohexadecyl)pyrimidin-1-ium IUPAC Name: 1-(5-fluorohexadecyl)pyrimidin-1-ium Traditional Name: 1-(5-fluorohexadecyl)pyrimidin-1-ium Formula: C20H36FN2+ MolecularWeight: 323.511643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCC[N+]1=CC=CN=C1)F

Isomeric SMILES

CCCCCCCCCCCC(CCCC[N+]1=CC=CN=C1)F

InChI

InChI=1S/C20H36FN2/c1-2-3-4-5-6-7-8-9-10-14-20(21)15-11-12-17-23-18-13-16-22-19-23/h13,16,18-20H,2-12,14-15,17H2,1H3/q+1