6-methyl-N-piperidin-1-ium-4-yl-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: 6-methyl-N-piperidin-1-ium-4-yl-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: 6-methyl-N-piperidin-1-ium-4-yl-2-(trifluoromethyl)quinazolin-4-amine CAS Name: 6-methyl-N-(4-piperidin-1-iumyl)-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: 6-methyl-N-piperidin-1-ium-4-yl-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [6-methyl-2-(trifluoromethyl)quinazolin-4-yl]-piperidin-1-ium-4-yl-amine Formula: C15H18F3N4+ MolecularWeight: 311.32543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2NC3CC[NH2+]CC3)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2NC3CC[NH2+]CC3)C(F)(F)F

InChI

InChI=1S/C15H17F3N4/c1-9-2-3-12-11(8-9)13(20-10-4-6-19-7-5-10)22-14(21-12)15(16,17)18/h2-3,8,10,19H,4-7H2,1H3,(H,20,21,22)/p+1