(1,3-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-yl)-phenyl-methanone tetrafluoroborate

Systemtic Name: (1,3-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-yl)-phenyl-methanone tetrafluoroborate Openeye Name: (1,3-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-yl)-phenyl-methanone tetrafluoroborate CAS Name: (1,3-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-yl)-phenylmethanone tetrafluoroborate IUPAC Name: (1,3-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-yl)-phenylmethanone tetrafluoroborate Traditional Name: (1,3-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-yl)-phenyl-methanone tetrafluoroborate Formula: C13H17BF4N2O MolecularWeight: 304.091493

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CN1CCC[N+](=C1C(=O)C2=CC=CC=C2)C

Isomeric SMILES

[B-](F)(F)(F)F.CN1CCC[N+](=C1C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C13H17N2O.BF4/c1-14-9-6-10-15(2)13(14)12(16)11-7-4-3-5-8-11;2-1(3,4)5/h3-5,7-8H,6,9-10H2,1-2H3;/q+1;-1