3-(2-methylpropoxy)propyl-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: 3-(2-methylpropoxy)propyl-[[3-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: 3-isobutoxypropyl-[[3-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: 3-(2-methylpropoxy)propyl-[[3-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: 3-(2-methylpropoxy)propyl-[[3-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: 3-isobutoxypropyl-[3-(trifluoromethyl)benzyl]ammonium Formula: C15H23F3NO+ MolecularWeight: 290.34443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCC[NH2+]CC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CC(C)COCCC[NH2+]CC1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C15H22F3NO/c1-12(2)11-20-8-4-7-19-10-13-5-3-6-14(9-13)15(16,17)18/h3,5-6,9,12,19H,4,7-8,10-11H2,1-2H3/p+1