6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinazoline

Systemtic Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinazoline Openeye Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinazoline CAS Name: 6-methyl-4-(1-piperazin-4-iumyl)-2-(trifluoromethyl)quinazoline IUPAC Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinazoline Traditional Name: 6-methyl-4-piperazin-4-ium-1-yl-2-(trifluoromethyl)quinazoline Formula: C14H16F3N4+ MolecularWeight: 297.29885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2N3CC[NH2+]CC3)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2N3CC[NH2+]CC3)C(F)(F)F

InChI

InChI=1S/C14H15F3N4/c1-9-2-3-11-10(8-9)12(21-6-4-18-5-7-21)20-13(19-11)14(15,16)17/h2-3,8,18H,4-7H2,1H3/p+1