pentan-3-yl-[[2-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: pentan-3-yl-[[2-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: 1-ethylpropyl-[[2-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: pentan-3-yl-[[2-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: pentan-3-yl-[[2-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: 1-ethylpropyl-[2-(trifluoromethyl)benzyl]ammonium Formula: C13H19F3N+ MolecularWeight: 246.29187

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CCC(CC)[NH2+]CC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C13H18F3N/c1-3-11(4-2)17-9-10-7-5-6-8-12(10)13(14,15)16/h5-8,11,17H,3-4,9H2,1-2H3/p+1