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

Systemtic Name: 4-(furan-2-yl)-2-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine Openeye Name: 4-(2-furyl)-2-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine CAS Name: 4-(2-furanyl)-2-(1-piperazin-4-iumyl)-6-(trifluoromethyl)pyrimidine IUPAC Name: 4-(furan-2-yl)-2-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine Traditional Name: 4-(2-furyl)-2-piperazin-4-ium-1-yl-6-(trifluoromethyl)pyrimidine Formula: C13H14F3N4O+ MolecularWeight: 299.27167

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C13H13F3N4O/c14-13(15,16)11-8-9(10-2-1-7-21-10)18-12(19-11)20-5-3-17-4-6-20/h1-2,7-8,17H,3-6H2/p+1