3-[[6-bromanyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[6-bromanyl-2-(trifluoromethyl)quinazolin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[6-bromo-2-(trifluoromethyl)-4-quinazolinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[6-bromo-2-(trifluoromethyl)quinazolin-4-yl]amino]propyl-dimethyl-ammonium Formula: C14H17BrF3N4+ MolecularWeight: 378.21079

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=NC(=NC2=C1C=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

C[NH+](C)CCCNC1=NC(=NC2=C1C=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C14H16BrF3N4/c1-22(2)7-3-6-19-12-10-8-9(15)4-5-11(10)20-13(21-12)14(16,17)18/h4-5,8H,3,6-7H2,1-2H3,(H,19,20,21)/p+1