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

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-butyl-ethyl-azanium Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]methyl-butyl-ethyl-ammonium CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]methyl-butyl-ethylammonium IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]methyl-butyl-ethylazanium Traditional Name: [5-(ammoniomethyl)-2-fluoro-benzyl]-butyl-ethyl-ammonium Formula: C14H25FN2+2 MolecularWeight: 240.360103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23FN2/c1-3-5-8-17(4-2)11-13-9-12(10-16)6-7-14(13)15/h6-7,9H,3-5,8,10-11,16H2,1-2H3/p+2