4-(1-methylpyridin-1-ium-4-yl)carbonylbenzaldehyde tetrafluoroborate

Systemtic Name: 4-(1-methylpyridin-1-ium-4-yl)carbonylbenzaldehyde tetrafluoroborate Openeye Name: 4-(1-methylpyridin-1-ium-4-carbonyl)benzaldehyde tetrafluoroborate CAS Name: 4-[(1-methyl-4-pyridin-1-iumyl)-oxomethyl]benzaldehyde tetrafluoroborate IUPAC Name: 4-(1-methylpyridin-1-ium-4-carbonyl)benzaldehyde tetrafluoroborate Traditional Name: 4-(1-methylpyridin-1-ium-4-carbonyl)benzaldehyde tetrafluoroborate Formula: C14H12BF4NO2 MolecularWeight: 313.055193

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C=O

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C=O

InChI

InChI=1S/C14H12NO2.BF4/c1-15-8-6-13(7-9-15)14(17)12-4-2-11(10-16)3-5-12;2-1(3,4)5/h2-10H,1H3;/q+1;-1