(1-methylpiperidin-1-ium-4-yl)-[[2-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: (1-methylpiperidin-1-ium-4-yl)-[[2-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: (1-methylpiperidin-1-ium-4-yl)-[[2-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: (1-methyl-4-piperidin-1-iumyl)-[[2-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: (1-methylpiperidin-1-ium-4-yl)-[[2-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: (1-methylpiperidin-1-ium-4-yl)-[2-(trifluoromethyl)benzyl]ammonium Formula: C14H21F3N2+2 MolecularWeight: 274.32515

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]CC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+]CC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H19F3N2/c1-19-8-6-12(7-9-19)18-10-11-4-2-3-5-13(11)14(15,16)17/h2-5,12,18H,6-10H2,1H3/p+2