(3-fluorophenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]azanium

Systemtic Name: (3-fluorophenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]azanium Openeye Name: [(1S,2S)-1,2-dimethylbutyl]-[(3-fluorophenyl)methyl]ammonium CAS Name: (3-fluorophenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]ammonium IUPAC Name: (3-fluorophenyl)methyl-[(2S,3S)-3-methylpentan-2-yl]azanium Traditional Name: [(1S,2S)-1,2-dimethylbutyl]-(3-fluorobenzyl)ammonium Formula: C13H21FN+ MolecularWeight: 210.310943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20FN/c1-4-10(2)11(3)15-9-12-6-5-7-13(14)8-12/h5-8,10-11,15H,4,9H2,1-3H3/p+1/t10-,11-/m0/s1