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

Systemtic Name: [(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-diethyl-azanium Openeye Name: [(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-diethyl-ammonium CAS Name: [(2S)-2-(ammoniomethyl)-3-(4-fluorophenyl)propyl]-diethylammonium IUPAC Name: [(2S)-2-(azaniumylmethyl)-3-(4-fluorophenyl)propyl]-diethylazanium Traditional Name: [(2S)-2-(ammoniomethyl)-3-(4-fluorophenyl)propyl]-diethyl-ammonium Formula: C14H25FN2+2 MolecularWeight: 240.360103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23FN2/c1-3-17(4-2)11-13(10-16)9-12-5-7-14(15)8-6-12/h5-8,13H,3-4,9-11,16H2,1-2H3/p+2/t13-/m0/s1