6,8-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline

Systemtic Name: 6,8-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline Openeye Name: 6,8-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline CAS Name: 6,8-dimethyl-4-(4-methyl-1-piperazin-4-iumyl)-2-(trifluoromethyl)quinazoline IUPAC Name: 6,8-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline Traditional Name: 6,8-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline Formula: C16H20F3N4+ MolecularWeight: 325.35201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=NC(=N2)C(F)(F)F)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=NC(=N2)C(F)(F)F)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C16H19F3N4/c1-10-8-11(2)13-12(9-10)14(21-15(20-13)16(17,18)19)23-6-4-22(3)5-7-23/h8-9H,4-7H2,1-3H3/p+1