6,7-bis(fluoranyl)-3-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]quinazolin-4-one

Systemtic Name: 6,7-bis(fluoranyl)-3-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]quinazolin-4-one Openeye Name: 6,7-difluoro-3-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]quinazolin-4-one CAS Name: 6,7-difluoro-3-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-4-quinazolinone IUPAC Name: 6,7-difluoro-3-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]quinazolin-4-one Traditional Name: 6,7-difluoro-3-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]quinazolin-4-one Formula: C13H11F2N4O+ MolecularWeight: 277.249446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(N1)CN2C=NC3=CC(=C(C=C3C2=O)F)F

Isomeric SMILES

CC1=C[NH+]=C(N1)CN2C=NC3=CC(=C(C=C3C2=O)F)F

InChI

InChI=1S/C13H10F2N4O/c1-7-4-16-12(18-7)5-19-6-17-11-3-10(15)9(14)2-8(11)13(19)20/h2-4,6H,5H2,1H3,(H,16,18)/p+1