2-tert-butyl-4-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine

Systemtic Name: 2-tert-butyl-4-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine Openeye Name: 2-tert-butyl-4-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine CAS Name: 2-tert-butyl-4-(1-piperazin-4-iumyl)-6-(trifluoromethyl)pyrimidine IUPAC Name: 2-tert-butyl-4-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine Traditional Name: 2-tert-butyl-4-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine Formula: C13H20F3N4+ MolecularWeight: 289.31991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CC(=N1)N2CC[NH2+]CC2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=NC(=CC(=N1)N2CC[NH2+]CC2)C(F)(F)F

InChI

InChI=1S/C13H19F3N4/c1-12(2,3)11-18-9(13(14,15)16)8-10(19-11)20-6-4-17-5-7-20/h8,17H,4-7H2,1-3H3/p+1