[(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-dimethyl-azanium

Systemtic Name: [(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-dimethyl-azanium Openeye Name: [(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-dimethyl-ammonium CAS Name: [(2S)-2-(ammoniomethyl)-3-(4-fluorophenyl)propyl]-dimethylammonium IUPAC Name: [(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-dimethylazanium Traditional Name: [(2S)-2-(ammoniomethyl)-3-(4-fluorophenyl)propyl]-dimethyl-ammonium Formula: C12H21FN2+2 MolecularWeight: 212.306943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19FN2/c1-15(2)9-11(8-14)7-10-3-5-12(13)6-4-10/h3-6,11H,7-9,14H2,1-2H3/p+2/t11-/m0/s1