1-isoquinolin-2-ium-2-yl-2,6-dimethyl-pyridin-4-one tetrafluoroborate

Systemtic Name: 1-isoquinolin-2-ium-2-yl-2,6-dimethyl-pyridin-4-one tetrafluoroborate Openeye Name: 1-isoquinolin-2-ium-2-yl-2,6-dimethyl-pyridin-4-one tetrafluoroborate CAS Name: 1-(2-isoquinolin-2-iumyl)-2,6-dimethyl-4-pyridinone tetrafluoroborate IUPAC Name: 1-isoquinolin-2-ium-2-yl-2,6-dimethylpyridin-4-one tetrafluoroborate Traditional Name: 1-isoquinolin-2-ium-2-yl-2,6-dimethyl-4-pyridone tetrafluoroborate Formula: C16H15BF4N2O MolecularWeight: 338.107713

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC(=O)C=C(N1[N+]2=CC3=CC=CC=C3C=C2)C

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC(=O)C=C(N1[N+]2=CC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C16H15N2O.BF4/c1-12-9-16(19)10-13(2)18(12)17-8-7-14-5-3-4-6-15(14)11-17;2-1(3,4)5/h3-11H,1-2H3;/q+1;-1