[(1R)-3-azaniumyl-1-(4-fluoranyl-3-methyl-phenyl)propyl]-dimethyl-azanium

Systemtic Name: [(1R)-3-azaniumyl-1-(4-fluoranyl-3-methyl-phenyl)propyl]-dimethyl-azanium Openeye Name: [(1R)-3-azaniumyl-1-(4-fluoro-3-methyl-phenyl)propyl]-dimethyl-ammonium CAS Name: [(1R)-3-ammonio-1-(4-fluoro-3-methylphenyl)propyl]-dimethylammonium IUPAC Name: [(1R)-3-azaniumyl-1-(4-fluoro-3-methylphenyl)propyl]-dimethylazanium Traditional Name: [(1R)-3-ammonio-1-(4-fluoro-3-methyl-phenyl)propyl]-dimethyl-ammonium Formula: C12H21FN2+2 MolecularWeight: 212.306943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19FN2/c1-9-8-10(4-5-11(9)13)12(6-7-14)15(2)3/h4-5,8,12H,6-7,14H2,1-3H3/p+2/t12-/m1/s1