[5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-diethyl-azanium

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-diethyl-azanium Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]methyl-diethyl-ammonium CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]methyl-diethylammonium IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]methyl-diethylazanium Traditional Name: [5-(ammoniomethyl)-2-fluoro-benzyl]-diethyl-ammonium Formula: C12H21FN2+2 MolecularWeight: 212.306943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19FN2/c1-3-15(4-2)9-11-7-10(8-14)5-6-12(11)13/h5-7H,3-4,8-9,14H2,1-2H3/p+2