[(1S,2S)-2-methyl-1-[3-(trifluoromethyl)phenyl]butyl]azanium

Systemtic Name: [(1S,2S)-2-methyl-1-[3-(trifluoromethyl)phenyl]butyl]azanium Openeye Name: [(1S,2S)-2-methyl-1-[3-(trifluoromethyl)phenyl]butyl]ammonium CAS Name: [(1S,2S)-2-methyl-1-[3-(trifluoromethyl)phenyl]butyl]ammonium IUPAC Name: [(1S,2S)-2-methyl-1-[3-(trifluoromethyl)phenyl]butyl]azanium Traditional Name: [(1S,2S)-2-methyl-1-[3-(trifluoromethyl)phenyl]butyl]ammonium Formula: C12H17F3N+ MolecularWeight: 232.26529

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC(=CC=C1)C(F)(F)F)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC(=CC=C1)C(F)(F)F)[NH3+]

InChI

InChI=1S/C12H16F3N/c1-3-8(2)11(16)9-5-4-6-10(7-9)12(13,14)15/h4-8,11H,3,16H2,1-2H3/p+1/t8-,11-/m0/s1