[(2S)-2-(4-fluoranyl-3-methyl-phenyl)-3-methyl-butyl]azanium

Systemtic Name: [(2S)-2-(4-fluoranyl-3-methyl-phenyl)-3-methyl-butyl]azanium Openeye Name: [(2S)-2-(4-fluoro-3-methyl-phenyl)-3-methyl-butyl]ammonium CAS Name: [(2S)-2-(4-fluoro-3-methylphenyl)-3-methylbutyl]ammonium IUPAC Name: [(2S)-2-(4-fluoro-3-methylphenyl)-3-methylbutyl]azanium Traditional Name: [(2S)-2-(4-fluoro-3-methyl-phenyl)-3-methyl-butyl]ammonium Formula: C12H19FN+ MolecularWeight: 196.284363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C[NH3+])C(C)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)[C@@H](C[NH3+])C(C)C)F

InChI

InChI=1S/C12H18FN/c1-8(2)11(7-14)10-4-5-12(13)9(3)6-10/h4-6,8,11H,7,14H2,1-3H3/p+1/t11-/m0/s1