[1-[[2-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]piperidin-1-ium-4-yl]azanium

Systemtic Name: [1-[[2-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]piperidin-1-ium-4-yl]azanium Openeye Name: [1-[[2-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]piperidin-1-ium-4-yl]ammonium CAS Name: [1-[[2-ethyl-5-(trifluoromethyl)-3-pyrazolyl]methyl]-4-piperidin-1-iumyl]ammonium IUPAC Name: [1-[[2-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]piperidin-1-ium-4-yl]azanium Traditional Name: [1-[[2-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methyl]piperidin-1-ium-4-yl]ammonium Formula: C12H21F3N4+2 MolecularWeight: 278.31715

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C(F)(F)F)C[NH+]2CCC(CC2)[NH3+]

Isomeric SMILES

CCN1C(=CC(=N1)C(F)(F)F)C[NH+]2CCC(CC2)[NH3+]

InChI

InChI=1S/C12H19F3N4/c1-2-19-10(7-11(17-19)12(13,14)15)8-18-5-3-9(16)4-6-18/h7,9H,2-6,8,16H2,1H3/p+2