(1-methylpiperidin-1-ium-4-yl)-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: (1-methylpiperidin-1-ium-4-yl)-[[3-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: (1-methylpiperidin-1-ium-4-yl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: (1-methyl-4-piperidin-1-iumyl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: (1-methylpiperidin-1-ium-4-yl)-[[3-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: (1-methylpiperidin-1-ium-4-yl)-[3-(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=C2)C(F)(F)F

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+]CC2=CC(=CC=C2)C(F)(F)F

InChI

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