2,6-dimethylheptan-4-yl-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: 2,6-dimethylheptan-4-yl-[[3-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: (1-isobutyl-3-methyl-butyl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: 2,6-dimethylheptan-4-yl-[[3-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: 2,6-dimethylheptan-4-yl-[[3-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: (1-isobutyl-3-methyl-butyl)-[3-(trifluoromethyl)benzyl]ammonium Formula: C17H27F3N+ MolecularWeight: 302.39819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26F3N/c1-12(2)8-16(9-13(3)4)21-11-14-6-5-7-15(10-14)17(18,19)20/h5-7,10,12-13,16,21H,8-9,11H2,1-4H3/p+1