6-azanyl-3-(dimethylamino)-2-(trifluoromethyl)-6H-quinazolin-3-ium-4-one

Systemtic Name: 6-azanyl-3-(dimethylamino)-2-(trifluoromethyl)-6H-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-(dimethylamino)-2-(trifluoromethyl)-6H-quinazolin-3-ium-4-one CAS Name: 6-amino-3-(dimethylamino)-2-(trifluoromethyl)-6H-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-(dimethylamino)-2-(trifluoromethyl)-6H-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-(dimethylamino)-2-(trifluoromethyl)-6H-quinazolin-3-ium-4-one Formula: C11H12F3N4O+ MolecularWeight: 273.23439

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)[N+]1=C(N=C2C=CC(C=C2C1=O)N)C(F)(F)F

Isomeric SMILES

CN(C)[N+]1=C(N=C2C=CC(C=C2C1=O)N)C(F)(F)F

InChI

InChI=1S/C11H12F3N4O/c1-17(2)18-9(19)7-5-6(15)3-4-8(7)16-10(18)11(12,13)14/h3-6H,15H2,1-2H3/q+1