2-methyl-3-pyridin-1-ium-1-yl-quinazolin-4-one tetrafluoroborate

Systemtic Name: 2-methyl-3-pyridin-1-ium-1-yl-quinazolin-4-one tetrafluoroborate Openeye Name: 2-methyl-3-pyridin-1-ium-1-yl-quinazolin-4-one tetrafluoroborate CAS Name: 2-methyl-3-(1-pyridin-1-iumyl)-4-quinazolinone tetrafluoroborate IUPAC Name: 2-methyl-3-pyridin-1-ium-1-ylquinazolin-4-one tetrafluoroborate Traditional Name: 2-methyl-3-pyridin-1-ium-1-yl-quinazolin-4-one tetrafluoroborate Formula: C14H12BF4N3O MolecularWeight: 325.069193

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=NC2=CC=CC=C2C(=O)N1[N+]3=CC=CC=C3

Isomeric SMILES

[B-](F)(F)(F)F.CC1=NC2=CC=CC=C2C(=O)N1[N+]3=CC=CC=C3

InChI

InChI=1S/C14H12N3O.BF4/c1-11-15-13-8-4-3-7-12(13)14(18)17(11)16-9-5-2-6-10-16;2-1(3,4)5/h2-10H,1H3;/q+1;-1